COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION
FULL DB
Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )
Direct access:
STL007712
Synonyms: N-(furan-2-ylmethyl)-N-[(2-hydroxyquinolin-3-yl)methyl]-3,4,5-trimethoxybenzamide
Smiles: COc1c(OC)cc(cc1OC)C(=O)N(Cc1cc2ccccc2nc1O)Cc1ccco1
STL007713
Synonyms: (3aS,4R,4aS,7aR,8R,8aS)-6-(4-methylphenyl)-3-(3-nitrophenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-epoxy[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@H]1O[C@@H]2[C@@H]2[C@H]1C(=NO2)c1cccc(c1)[N+](=O)[O-]
STL007715
Synonyms: 3-[4-(dimethylamino)phenyl]-1-(2,6-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-2,5-dione
Smiles: COc1ccc(cc1)N1C(=O)CN(C(=O)C1c1ccc(cc1)N(C)C)c1c(C)cccc1C
STL007716
Synonyms: 13-methyl-1'-(2-phenylethyl)-1,2,3,4,5,5a-hexahydro-2'H,7H,8H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2-a]azepine-6,5'-pyrimidine]-2',4',6',8(1'H,3'H)-tetrone
Smiles: O=C1NC(=O)C2(C(=O)N1CCc1ccccc1)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C
STL007717
Synonyms: 3-(2,5-dimethylphenyl)-6-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)pyrimidine-2,4(1H,3H)-dione
Smiles: COc1ccc2c(c1)c1CCNC(c1[nH]2)c1c(O)[nH]c(=O)n(c1=O)c1cc(C)ccc1C
STL007718
Synonyms: (3S,3a'R,8a'S,8b'S)-5-chloro-2'-[2-chloro-5-(trifluoromethyl)phenyl]-7-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Clc1cc(C)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1Cl)C(F)(F)F
STL007720
Synonyms: 1,3-dimethyl-7'-{[1-(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)propyl]amino}-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CCC(=C1C(=O)NC(=O)NC1=O)Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C
STL007721
Synonyms: 3-(2-ethoxyphenoxy)-7-hydroxy-8-[(4-methylpiperidin-1-yl)methyl]-4H-chromen-4-one
Smiles: CCOc1ccccc1Oc1coc2c(c1=O)ccc(c2CN1CCC(CC1)C)O
STL007722
Synonyms: 4-(4-bromophenyl)-3-(4-methoxyphenyl)-5-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Smiles: COc1ccc(cc1)c1n[nH]c2c1C(c1ccc(cc1)Br)N(C2=O)c1ccccc1
STL007723
Synonyms: (2Z)-7-{[bis(2-methoxyethyl)amino]methyl}-6-hydroxy-2-[4-(propan-2-yl)benzylidene]-1-benzofuran-3(2H)-one
Smiles: COCCN(Cc1c(O)ccc2c1O/C(=C\c1ccc(cc1)C(C)C)/C2=O)CCOC
STL007724
Synonyms: (3aR,6aS)-5-(4-butylphenyl)-3-(2,4-dichlorophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: CCCCc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccc(cc1Cl)Cl
STL007725
Synonyms: 7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-8-{[3-(morpholin-4-yl)propyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(NCCCN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)C
STL007726
Synonyms: 8,10,10-trimethyl-10a-[(E)-2-(naphthalen-1-yl)ethenyl]-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: O=C1CCN2C(N1)(/C=C/c1cccc3c1cccc3)C(C)(C)c1c2ccc(c1)C
STL007727
Synonyms: 1'-(3,5-dimethylphenyl)-2,4-dimethyl-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=O)NC(=O)N(C1=O)c1cc(C)cc(c1)C)[N+](=O)[O-]
STL007728
Synonyms: (2Z)-6-hydroxy-7-[(2-methylpiperidin-1-yl)methyl]-2-(4-nitrobenzylidene)-1-benzofuran-3(2H)-one
Smiles: CC1CCCCN1Cc1c(O)ccc2c1O/C(=C\c1ccc(cc1)[N+](=O)[O-])/C2=O
STL007729
Synonyms: 3-benzyl-1'-tert-butyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1NC(=O)C2(C(=O)N1C(C)(C)C)Cc1ccccc1N1C2CN(CC1)Cc1ccccc1
STL007730
Synonyms: 4-{2-(2-fluorophenyl)-4-hydroxy-3-[(4-methylphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1F)c1ccc(cc1)S(=O)(=O)N
STL007731
Synonyms: (3R,3'S,3a'S,6a'R)-5'-(4-chloro-2-methoxy-5-methylphenyl)-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CSCC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1cc(C)c(cc1OC)Cl)C(=O)Nc1c2cccc1
STL007732
Synonyms: 3-methyl-7-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-8-(pyrrolidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1nnc(s1)SCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCC1
STL007733
Synonyms: 1'-butyl-1-(2,4-dimethylphenyl)-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCC1N(CCCC)c2ccc(cc2CC21C(=O)NC(=O)N(C2=O)c1ccc(cc1C)C)[N+](=O)[O-]
STL007734
Synonyms: 4-{4-[(4-chlorophenoxy)methyl]piperazin-1-yl}-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide
Smiles: CCCc1nnc(s1)NC(=O)CCC(=O)N1CCN(CC1)COc1ccc(cc1)Cl
STL007735
Synonyms: (6E)-6-{[1-(2-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-methyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3ccccc3O)C)/C2=N)s1
STL007737
Synonyms: 5-methyldihydropyrimidine-2,4(1H,3H)-dione
Smiles: CC1CNC(=O)NC1=O
STL007738
Synonyms: 7-(2-ethoxyethyl)-8-[(4-methoxybenzyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCOCCn1c(NCc2ccc(cc2)OC)nc2c1c(=O)[nH]c(=O)n2C
STL007739
Synonyms: 9-(4-butylphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)[nH]c(=O)n1C
STL007740
Synonyms: N-{6-[(4-{[(9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl]oxy}-4-oxobutanoyl)amino]hexanoyl}isoleucine
Smiles: CCC(C(C(=O)O)NC(=O)CCCCCNC(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CCC1[C@H]2CCC2=CC(=O)CC[C@]12C)C
STL007741
Synonyms: N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-N-(2-methoxyethyl)acetamide
Smiles: COCCN(C(=O)C)Cc1cc2cccc(c2nc1O)C
STL007742
Synonyms: N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-3,4-dimethoxybenzamide
Smiles: COc1ccc(cc1OC)C(=O)Nc1nnc(s1)c1ccc(cc1)C(C)(C)C
STL007743
Synonyms: 8-({(Z)-[1-(butan-2-yl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-3-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCC(N1C(=O)NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=O)NC(=O)NC2=O)/C1=O)C
STL007744
Synonyms: 1-(2-fluorophenyl)-4-(4-methylphenyl)-3-phenylpiperazine-2,5-dione
Smiles: Cc1ccc(cc1)N1C(=O)CN(C(=O)C1c1ccccc1)c1ccccc1F
STL007745
Synonyms: 7-(3-chlorobenzyl)-8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1cccc(c1)Cl)c(=O)[nH]c(=O)n2C
STL007746
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-bromophenyl)carbonyl]-2'-(pyridin-3-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Brc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccnc1)C(=O)Nc1c2cccc1)cccc3
STL007748
Synonyms: 1'-[2-(3,4-dimethoxyphenyl)ethyl]-3-nitro-6a,7,8,9,10,11-hexahydro-2'H,5H-spiro[azepino[1,2-a]quinoline-6,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-]
STL007749
Synonyms: 4-[({6-[(4-{[(9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl]oxy}-4-oxobutanoyl)amino]hexanoyl}amino)methyl]benzoicacid
Smiles: O=C(CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CCC1[C@H]2CCC2=CC(=O)CC[C@]12C)NCCCCCC(=O)NCc1ccc(cc1)C(=O)O
STL007750
Synonyms: N-[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanoyl]-L-leucyl-L-alanine
Smiles: CC(C[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1ccccc1)C
STL007751
Synonyms: 7-(2-methoxyethyl)-3-methyl-8-(phenylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(Sc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
STL007752
Synonyms: 2-({4-[1-(4-chlorophenyl)ethyl]-5-sulfanyl-4H-1,2,4-triazol-3-yl}methyl)phthalazin-1(2H)-one
Smiles: Clc1ccc(cc1)C(n1c(S)nnc1Cn1ncc2c(c1=O)cccc2)C
STL007753
Synonyms: (2Z)-2-(2,4-dioxo-1,3-thiazolidin-5-ylidene)-N-[2-(4-methoxyphenyl)ethyl]ethanamide
Smiles: COc1ccc(cc1)CCNC(=O)/C=C/1\SC(=O)NC1=O
STL007754
Synonyms: 2-amino-7,9-dimethyl-4-(4-methylphenyl)-5-oxo-5,6-dihydro-4H-pyrano[2,3-d]thieno[3,2-b:5,4-b']dipyridine-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)C)c(=O)[nH]c1c2sc2c1c(C)cc(n2)C
STL007755
Synonyms: 8-[(2E)-2-(4-ethoxybenzylidene)hydrazinyl]-7-(2-hydroxy-2-phenylethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCOc1ccc(cc1)/C=N/Nc1nc2c(n1CC(c1ccccc1)O)c(=O)[nH]c(=O)n2C
STL007757
Synonyms: N~6~-(tert-butoxycarbonyl)-N~2~-[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-(1H-indol-3-yl)propanoyl]-L-lysine
Smiles: O=C(OC(C)(C)C)NCCCC[C@@H](C(=O)O)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1c[nH]c2c1cccc2
STL007758
Synonyms: 1,3-dimethyl-7'-{(Z)-[1-(4-methylpentyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CC(CCCN1C(=O)NC(=O)/C(=C/c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)C
STL007759
Synonyms: N-[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanoyl]-L-valyl-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1ccccc1
STL007760
Synonyms: (3S,3a'R,8a'S,8b'S)-5-chloro-2'-(5-chloro-2-methylphenyl)-7-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Clc1ccc(c(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2C)C
STL007761
Synonyms: 2-hydroxy-9-(4-methoxyphenyl)-7-phenylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: COc1ccc(cc1)c1cc(nc2c1c1nc(O)[nH]c(=O)c1s2)c1ccccc1
STL007762
Synonyms: 9-(1,3-benzodioxol-5-yl)-6,6-dimethyl-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccc3c(c1)OCO3)n1c(N2)nc(n1)C(F)(F)F
STL007763
Synonyms: N~2~-[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanoyl]-L-glutaminyl-D-asparagine
Smiles: NC(=O)CC[C@@H](C(=O)N[C@@H](C(=O)O)CC(=O)N)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1ccccc1
STL007764
Synonyms: 8-{[2-(dimethylamino)ethyl]amino}-3-methyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN(CCNc1nc2c(n1Cc1ccc(cc1)C)c(=O)[nH]c(=O)n2C)C
STL007765
Synonyms: 7-(4-fluorobenzyl)-8-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccc(cc1)F)c(=O)[nH]c(=O)n2C
STL007766
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2,5-dimethoxyphenyl)-7-ethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: COc1ccc(c(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2CC)OC
STL007767
Synonyms: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-2-(3-bromophenyl)-3,5-dihydro-4H-imidazol-4-one
Smiles: Brc1cccc(c1)C1=N/C(=C\c2ccc3c(c2)OCO3)/C(=O)N1
STL007768
Synonyms: N-[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanoyl]-L-alanyl-L-alanine
Smiles: C[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1ccccc1
STL007769
Synonyms: 4-chloro-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)benzamide
Smiles: Clc1ccc(cc1)C(=O)N(Cc1cc2cc(C)ccc2nc1O)CC1CCCO1
STL007770
Synonyms: 8-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-7-(2-hydroxy-2-phenylethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)/C=N/Nc1nc2c(n1CC(c1ccccc1)O)c(=O)[nH]c(=O)n2C
STL007771
Synonyms: 2-bromo-N-[(2-hydroxyquinolin-3-yl)methyl]-N-(2-methylpropyl)benzamide
Smiles: CC(CN(C(=O)c1ccccc1Br)Cc1cc2ccccc2nc1O)C
STL007772
Synonyms: 8-[benzyl(methyl)amino]-3-methyl-7-[3-(pyrimidin-2-ylsulfanyl)propyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2CCCSc1ncccn1)N(Cc1ccccc1)C
STL007773
Synonyms: (3S,3a'R,8a'S,8b'S)-7-chloro-2'-(2,5-dimethoxyphenyl)-5-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(C)cc2Cl)OC
STL007774
Synonyms: (5Z)-5-[(6-chloro-4-oxo-4H-chromen-3-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: Clc1cc2c(=O)c(/C=C/3\SC(=S)NC3=O)coc2cc1
STL007775
Synonyms: 3-methyl-8-({(Z)-[2,4,6-trioxo-1-(propan-2-yl)tetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)N/C=C\2/C(=O)NC(=O)N(C2=O)C(C)C)C(=O)NC(=O)NC1=O
STL007777
Synonyms: 6-(4-methylphenyl)-3-(4-nitrophenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-epoxy[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)C2C(C1=O)C1OC2C2C1ON=C2c1ccc(cc1)[N+](=O)[O-]
STL007778
Synonyms: (5E)-2-(4-bromophenyl)-5-(furan-2-ylmethylidene)-3,5-dihydro-4H-imidazol-4-one
Smiles: Brc1ccc(cc1)C1=N/C(=C/c2ccco2)/C(=O)N1
STL007779
Synonyms: (3S,3a'R,8a'S,8b'S)-7-chloro-2'-(2-fluorophenyl)-5-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1cc(Cl)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1F
STL007780
Synonyms: 8-[4-(2-hydroxyethyl)piperazin-1-yl]-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCN1CCN(CC1)c1nc2c(n1CC(COc1cccc(c1)C)O)c(=O)[nH]c(=O)n2C
STL007781
Synonyms: 6,8-dibromo-N-hexyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCCCNC(=O)c1c(=O)[nH]c2c(c1O)cc(cc2Br)Br
STL007783
Synonyms: ethyl4-{7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1nc2c(n1CCSc1nc3c(s1)cccc3)c(=O)[nH]c(=O)n2C
STL007785
Synonyms: 1'-(4-fluorophenyl)-2,4-dimethyl-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=O)NC(=O)N(C1=O)c1ccc(cc1)F)[N+](=O)[O-]
STL007786
Synonyms: 1-(2,5-dimethoxyphenyl)-4-(2,4-dimethylphenyl)-3-(thiophen-3-yl)piperazine-2,5-dione
Smiles: COc1ccc(c(c1)N1CC(=O)N(C(C1=O)c1ccsc1)c1ccc(cc1C)C)OC
STL007787
Synonyms: 8-(4-ethylpiperazin-1-yl)-3-methyl-7-(2-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1Cc1ccccc1C)c(=O)[nH]c(=O)n2C
STL007788
Synonyms: 5-{(2E)-3-[4-(diethylamino)phenyl]prop-2-enoyl}-3-(4-ethoxyphenyl)-6-hydroxypyrimidine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)n1c(=O)[nH]c(c(c1=O)C(=O)/C=C/c1ccc(cc1)N(CC)CC)O
STL007790
Synonyms: N-{6-[(4-{[(9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl]oxy}-4-oxobutanoyl)amino]hexanoyl}phenylalanine
Smiles: O=C(CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CCC1[C@H]2CCC2=CC(=O)CC[C@]12C)NCCCCCC(=O)NC(C(=O)O)Cc1ccccc1
STL007791
Synonyms: N-[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-(1H-indol-3-yl)propanoyl]-L-alanyl-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1c[nH]c2c1cccc2)C
STL007792
Synonyms: 4-(4-chlorophenyl)-1-(2,6-dimethylphenyl)-3-(thiophen-3-yl)piperazine-2,5-dione
Smiles: Clc1ccc(cc1)N1C(=O)CN(C(=O)C1c1cscc1)c1c(C)cccc1C
STL007794
Synonyms: 7-[2-hydroxy-3-(4-methylphenoxy)propyl]-8-[(3-hydroxypropyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCCNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(=O)[nH]c(=O)n2C
STL007795
Synonyms: 4-({6-[(4-{[(9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl]oxy}-4-oxobutanoyl)amino]hexanoyl}amino)-3-phenylbutanoicacid
Smiles: O=C(CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CCC1[C@H]2CCC2=CC(=O)CC[C@]12C)NCCCCCC(=O)NCC(c1ccccc1)CC(=O)O
STL007796
Synonyms: 9-(4-hydroxyphenyl)-6-(4-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1n(C2c2ccc(cc2)O)ncn1
STL007797
Synonyms: (5E)-1-(4-chlorophenyl)-5-[(6-hydroxy-4-oxo-4H-chromen-3-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2coc3c(c2=O)cc(cc3)O)/C1=O
STL007798
Synonyms: 6-hydroxy-5-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]-3-(2-phenylethyl)pyrimidine-2,4(1H,3H)-dione
Smiles: COc1cc(/C=C/C(=O)c2c(O)[nH]c(=O)n(c2=O)CCc2ccccc2)ccc1O
STL007799
Synonyms: (5Z)-5-[5-(3,4-dimethoxyphenyl)-1-phenylpyrazolidin-3-ylidene]-1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1OC)C1C/C(=C/2\C(=O)NC(=O)N(C2=O)CCc2ccccc2)/NN1c1ccccc1
STL007800
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2,3-dichlorophenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2cccc(c2Cl)Cl)C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1cccc2
STL007801
Synonyms: 8-[(furan-2-ylmethyl)amino]-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(NCc2ccco2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)C
STL007804
Synonyms: ethyl2-{[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-4-(5-methylfuran-2-yl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC=C2C(=O)NC(=S)NC2=O)scc1c1ccc(o1)C
STL007805
Synonyms: (3S,3a'R,8a'S,8b'S)-5-chloro-2'-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Clc1cc(C)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCCO2
STL007807
Synonyms: 3-butyl-5-(3-butyl-9-methoxy-2,4-dioxo-1,3,4,5-tetrahydro-2H-chromeno[2,3-d]pyrimidin-5-yl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: CCCCn1c(=O)[nH]c(=O)c(c1[O-])C1c2cccc(c2Oc2c1c(=O)n(c(=O)[nH]2)CCCC)OC
STL007808
Synonyms: 7-(3-chlorobenzyl)-3-methyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cccc(c1)Cn1c(CN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C
STL007809
Synonyms: beta-hydroxy-N-[({[(3E,9xi,14xi,17beta)-17-hydroxy-17-methylandrost-4-en-3-ylidene]amino}oxy)acetyl]-3-nitrophenylalanine
Smiles: O=C(NC(C(c1cccc(c1)[N+](=O)[O-])O)C(=O)O)CO/N=C/1\CC[C@]2(C(=C1)CC[C@@H]1C2CC[C@]2(C1CC[C@]2(C)O)C)C
STL007810
Synonyms: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-2-(4-bromophenyl)-3,5-dihydro-4H-imidazol-4-one
Smiles: Brc1ccc(cc1)C1=N/C(=C/c2ccc3c(c2)OCO3)/C(=O)N1
STL007811
Synonyms: 5-[(2E)-3-(4-chlorophenyl)prop-2-enoyl]-6-hydroxy-3-(2-phenylethyl)pyrimidine-2,4(1H,3H)-dione
Smiles: Clc1ccc(cc1)/C=C/C(=O)c1c(O)[nH]c(=O)n(c1=O)CCc1ccccc1
STL007812
Synonyms: 1'-(2,2-dimethoxyethyl)-6'-nitro-1-phenyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: COC(CN1CC2(Cc3c1ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C2=O)c1ccccc1)OC
STL007813
Synonyms: 1-(2,3-dimethylphenyl)-3-(4-methylphenyl)-4-phenylpiperazine-2,5-dione
Smiles: Cc1ccc(cc1)C1N(c2ccccc2)C(=O)CN(C1=O)c1cccc(c1C)C
STL007814
Synonyms: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-(3,5-dimethylphenyl)-6-hydroxypyrimidine-2,4(1H,3H)-dione
Smiles: COc1cc2c(cc1OC)CCNC2c1c(O)[nH]c(=O)n(c1=O)c1cc(C)cc(c1)C
STL007815
Synonyms: (3R,3'S,3a'S,6a'R)-5'-(2,3-dihydro-1,4-benzodioxin-6-yl)-3'-(1H-indol-3-ylmethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: O=C1N(c2ccc3c(c2)OCCO3)C(=O)[C@@H]2[C@H]1[C@H](Cc1c[nH]c3c1cccc3)N[C@@]12C(=O)Nc2c1cccc2
STL007816
Synonyms: (3aS,4R,4aS,7aR,8R,8aS)-6-(4-acetylphenyl)-3-(3-nitrophenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-epoxy[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: O=C1N(c2ccc(cc2)C(=O)C)C(=O)[C@@H]2[C@H]1[C@H]1O[C@@H]2[C@@H]2[C@H]1C(=NO2)c1cccc(c1)[N+](=O)[O-]
STL007817
Synonyms: 1-(4-chlorophenyl)-1'-(2,2-dimethoxyethyl)-6'-nitro-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: COC(CN1CC2(Cc3c1ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C2=O)c1ccc(cc1)Cl)OC
STL007819
Synonyms: 1'-methyl-1-(3-methylphenyl)-6'-nitro-2'-phenyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: Cc1cccc(c1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N(C2c1ccccc1)C)[N+](=O)[O-]
STL007821
Synonyms: 1-methyl-8-(3-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Cc1cccc(c1)N1CCn2c1nc1c2c(=O)[nH]c(=O)n1C
STL007822
Synonyms: 8-[(4-benzylpiperazin-1-yl)methyl]-3-methyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(CN2CCN(CC2)Cc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)C
STL007824
Synonyms: 3-methyl-7-(2-methylprop-2-en-1-yl)-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=C)Cn1c(CN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C
STL007826
Synonyms: (3S,3a'R,8a'S,8b'S)-7-chloro-2'-(3-chloro-4-fluorophenyl)-5-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1cc(Cl)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(c(c1)Cl)F
STL007827
Synonyms: N-[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanoyl]-S-{[(phenylcarbonyl)amino]methyl}-L-cysteine
Smiles: OC(=O)[C@@H](NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1ccccc1)CSCNC(=O)c1ccccc1
STL007828
Synonyms: 1-(2,3-dimethylphenyl)-4-(2,4-dimethylphenyl)-3-(furan-2-yl)piperazine-2,5-dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)CN(C(=O)C1c1ccco1)c1cccc(c1C)C
STL007829
Synonyms: (5E)-1-(5-chloro-2-methylphenyl)-5-{[(2-phenylethyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\NCCc2ccccc2)/C1=O)C
STL007830
Synonyms: 8-bromo-7-[(2E)-2-(2-{7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}hydrazinylidene)ethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(N/N=C/Cn2c(Br)nc3c2c(=O)n(C)c(=O)n3C)nc2c1c(=O)n(c(=O)n2C)C)COc1ccccc1C
STL007833
Synonyms: 5-(1,3-benzodioxol-5-yl)-2-[(4-fluorobenzyl)sulfanyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Smiles: O=C1Nc2nc(SCc3ccc(cc3)F)[nH]c(=O)c2C(C1)c1ccc2c(c1)OCO2
STL007834
Synonyms: (3S,3a'R,8a'S,8b'S)-7-ethyl-2'-[3-(trifluoromethyl)phenyl]-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F
STL007836
Synonyms: N-[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-(1H-indol-3-yl)propanoyl]-L-valyl-L-valine
Smiles: CC([C@@H](C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1c[nH]c2c1cccc2)C
STL007837
Synonyms: 1'-butyl-1-hexyl-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCCCCN1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N(C2CCC)CCCC)[N+](=O)[O-]
STL007838
Synonyms: 5-[(2E)-3-(1-benzyl-1H-indol-3-yl)prop-2-enoyl]-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione
Smiles: CCCCn1c(=O)[nH]c(c(c1=O)C(=O)/C=C/c1cn(c2c1cccc2)Cc1ccccc1)O
STL007839
Synonyms: 3-butyl-5-[(2E)-3-(2,4-dimethoxyphenyl)prop-2-enoyl]-6-hydroxypyrimidine-2,4(1H,3H)-dione
Smiles: CCCCn1c(=O)[nH]c(c(c1=O)C(=O)/C=C/c1ccc(cc1OC)OC)O
STL007840
Synonyms: N-[(2-hydroxyquinolin-3-yl)methyl]-4-methoxy-N-(pyridin-3-ylmethyl)benzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2ccccc2nc1O)Cc1cccnc1
STL007842
Synonyms: N-benzyl-N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-2-methylpropanamide
Smiles: Cc1ccc2c(c1)nc(c(c2)CN(C(=O)C(C)C)Cc1ccccc1)O
STL007843
Synonyms: 1,3-dimethyl-7'-({(1E)-1-[2,4,6-trioxo-1-(prop-2-en-1-yl)tetrahydropyrimidin-5(2H)-ylidene]propyl}amino)-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trio
Smiles: C=CCN1C(=O)NC(=O)/C(=C(\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/CC)/C1=O
STL007844
Synonyms: N-[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-(1H-indol-3-yl)propanoyl]-L-alanyl-L-phenylalanine
Smiles: O=C([C@@H](NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1c[nH]c2c1cccc2)C)N[C@H](C(=O)O)Cc1ccccc1
STL007846
Synonyms: N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-2-(3-methylphenoxy)acetamide
Smiles: COc1cc(ccc1OC)Cc1nnc(s1)NC(=O)COc1cccc(c1)C
STL007847
Synonyms: 4-(5-chloro-2-methoxyphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1n1c(S)nnc1c1cnccn1)Cl
STL007848
Synonyms: (1'R,2'S)-7'-chloro-2'-(2-chlorophenyl)-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1ccccc1Cl)C(=O)c1c(C2=O)cccc1)Cl
STL007849
Synonyms: 4-fluoro-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)benzamide
Smiles: Fc1ccc(cc1)C(=O)N(Cc1cc2cc(C)ccc2nc1O)CC1CCCO1
STL007850
Synonyms: 8-(4-ethylpiperazin-1-yl)-3-methyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CC
STL007851
Synonyms: 7-(2-fluorobenzyl)-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCN1CCN(CC1)c1nc2c(n1Cc1ccccc1F)c(=O)[nH]c(=O)n2C
STL007852
Synonyms: N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(2-methoxyethyl)-2-methylpropanamide
Smiles: COCCN(C(=O)C(C)C)Cc1cc2cc(C)ccc2nc1O
STL007853
Synonyms: 6-hydroxy-3-(4-methylphenyl)-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)pyrimidine-2,4(1H,3H)-dione
Smiles: Cc1ccc(cc1)n1c(=O)[nH]c(c(c1=O)C1NCCc2c1[nH]c1c2cccc1)O
STL007854
Synonyms: 7-chloro-1'-[2-(3,4-dimethoxyphenyl)ethyl]-3-ethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCN1CCN2C(C1)C1(Cc3c2cccc3Cl)C(=O)NC(=O)N(C1=O)CCc1ccc(c(c1)OC)OC
STL007855
Synonyms: (2Z)-7-{[butyl(methyl)amino]methyl}-6-hydroxy-2-(3-methoxybenzylidene)-1-benzofuran-3(2H)-one
Smiles: CCCCN(Cc1c(O)ccc2c1O/C(=C\c1cccc(c1)OC)/C2=O)C
STL007856
Synonyms: 1'-(4-chlorophenyl)-3-phenyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1ccccc1N1C2CN(CC1)c1ccccc1
STL007857
Synonyms: 2-(methylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)Nc2c1c(=O)[nH]c(n2)SC
STL007858
Synonyms: 8-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-7-(4-fluorobenzyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)Cn1c(N/N=C/c2ccc(cc2)Cl)nc2c1c(=O)[nH]c(=O)n2C
STL007859
Synonyms: 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Smiles: COc1ccc(cc1)c1n[nH]c2c1C(c1ccc(cc1)Cl)N(C2=O)c1ccccc1
STL007861
Synonyms: 8-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-7-butyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCn1c(N/N=C/c2ccc(cc2)Br)nc2c1c(=O)[nH]c(=O)n2C
STL007862
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(c(c2)OC)O)C(=C(C1=O)O)C(=O)c1ccc2c(c1)OCCO2
STL007863
Synonyms: 9a-[(E)-2-(2-ethoxyphenyl)ethenyl]-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: CCOc1ccccc1/C=C/C12NC(=O)CN1c1c(C2(C)C)cc(cc1)C
STL007864
Synonyms: 5-[3-methoxy-4-(2-phenylethoxy)phenyl]-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Smiles: COc1cc(ccc1OCCc1ccccc1)C1CC(=O)Nc2c1c(=O)[nH]c(n2)c1ccccc1
STL007866
Synonyms: 2-(6,6-dimethyl-2,4-dioxo-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)-N-(furan-2-ylmethyl)acetamide
Smiles: O=C(Cn1c(=O)[nH]c2c(c1=O)c1CC(C)(C)OCc1s2)NCc1ccco1
STL007867
Synonyms: 6-benzyl-1-(4-methoxyphenyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)n1c(=S)[nH]c(=O)c2c1NCN(C2)Cc1ccccc1
STL007868
Synonyms: 4-(4-bromophenyl)-1-(2,6-dimethylphenyl)-3-[4-(propan-2-yl)phenyl]piperazine-2,5-dione
Smiles: Brc1ccc(cc1)N1C(=O)CN(C(=O)C1c1ccc(cc1)C(C)C)c1c(C)cccc1C
STL007870
Synonyms: N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridazine-3-carboxamide
Smiles: Clc1ccc(s1)c1csc(n1)NC(=O)C1=NN(C(=O)CC1)c1ccccc1
STL007872
Synonyms: 7-(4-fluorobenzyl)-3-methyl-8-[(4-methylpiperazin-1-yl)amino]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)c(=O)[nH]c(=O)n2C
STL007873
Synonyms: 6'-chloro-1,3-dimethyl-7'-[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1NC(=O)C(=Cc2ccc3c(c2Cl)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)C(=O)N1
STL007874
Synonyms: 2-{4-oxo-2-[(4-phenoxyphenyl)amino]-4,5-dihydro-1H-imidazol-5-yl}-N-phenylacetamide
Smiles: O=C(CC1NC(=NC1=O)Nc1ccc(cc1)Oc1ccccc1)Nc1ccccc1
STL007875
Synonyms: (2R)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenyl-N-(3-phenylpropyl)propanamide
Smiles: O=c1[nH]c2ccccc2c(=O)n1[C@@H](C(=O)NCCCc1ccccc1)Cc1ccccc1
STL007876
Synonyms: 2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-(3-fluorophenyl)butanamide
Smiles: CCC(n1c(=O)[nH]c2c(c1=O)cccc2)C(=O)Nc1cccc(c1)F
STL007877
Synonyms: 5-(4-fluorophenyl)-4-(4-hydroxy-3-methoxyphenyl)-3-(4-methylphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Smiles: COc1cc(ccc1O)C1c2c(n[nH]c2C(=O)N1c1ccc(cc1)F)c1ccc(cc1)C
STL007878
Synonyms: 2-[(11aS)-5-(3-methoxyphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-(6-methylheptan-2-yl)benzamide
Smiles: COc1cccc(c1)C1N2[C@@H](Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)NC(CCCC(C)C)C
STL007879
Synonyms: 8-(azepan-1-ylmethyl)-3-(2,5-dimethoxyphenyl)-7-hydroxy-4-methyl-2H-chromen-2-one
Smiles: COc1ccc(cc1c1c(=O)oc2c(c1C)ccc(c2CN1CCCCCC1)O)OC
STL007880
Synonyms: ethyl2-{[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(/N=C/c2cccc(c2O)OC)sc2c1CCC2
STL007881
Synonyms: (1'R,2'R)-2'-(4-chlorophenyl)-1'-[(3-methoxyphenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1ccc(cc1)Cl)C(=O)c1c(C2=O)cccc1)C
STL007883
Synonyms: 3-hydroxy-5-(3-nitrophenyl)-4-(phenylcarbonyl)-1-(tetrahydrofuran-2-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=C(C(N1CC1CCCO1)c1cccc(c1)[N+](=O)[O-])C(=O)c1ccccc1)O
STL007884
Synonyms: (2R)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-(furan-2-ylmethyl)-3-phenylpropanamide
Smiles: O=c1[nH]c2ccccc2c(=O)n1[C@@H](C(=O)NCc1ccco1)Cc1ccccc1
STL007885
Synonyms: ethyl4-[({4-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]-4,5-dihydro-1H-imidazol-5-yl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CC1NC(=NC1=O)N1CCN(CC1)c1ccccn1
STL007886
Synonyms: 2-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-4,5-dihydro-1H-imidazol-5-yl}-N-phenylacetamide
Smiles: COc1ccc(cc1)N1CCN(CC1)C1=NC(=O)C(N1)CC(=O)Nc1ccccc1
STL007887
Synonyms: 3-(4-methoxyphenyl)-1'-methyl-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(cc1)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)C
STL007888
Synonyms: 8-[4-(3-chlorobenzyl)piperazin-1-yl]-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=C)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1cccc(c1)Cl
STL007889
Synonyms: 4-chloro-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(2-methoxyethyl)benzamide
Smiles: COCCN(C(=O)c1ccc(cc1)Cl)Cc1cc2cc(C)ccc2nc1O
STL007890
Synonyms: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]pyridine-2-carboxamide
Smiles: CCN(S(=O)(=O)c1ccc2c(c1)sc(n2)NC(=O)c1ccccn1)CC
STL007891
Synonyms: 8-[4-(4-chlorobenzyl)piperazin-1-yl]-3-methyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccc(cc1)Cl)C
STL007892
Synonyms: 2-chloro-N-[2-(6-{(1E)-3-[6-hydroxy-2,4-dioxo-3-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidin-5-yl]-3-oxoprop-1-en-1-yl}-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-N-methylbenzamide
Smiles: C=CCn1c(=O)[nH]c(c(c1=O)C(=O)/C=C/c1c(CCN(C(=O)c2ccccc2Cl)C)cc2c(c1OC)OCO2)O
STL007893
Synonyms: 1-(4-chlorophenyl)-N-cyclohexyl-4-oxo-2-[4-(propan-2-yl)phenyl]azetidine-2-carboxamide
Smiles: Clc1ccc(cc1)N1C(=O)CC1(C(=O)NC1CCCCC1)c1ccc(cc1)C(C)C
STL007894
Synonyms: (2S)-N-[4-(acetylamino)phenyl]-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)propanamide
Smiles: CC(=O)Nc1ccc(cc1)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)C
STL007895
Synonyms: 2,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-indole-5-carboxamide
Smiles: Cc1nnc(s1)NC(=O)c1ccc2c(c1)c(C)c([nH]2)C
STL007896
Synonyms: (1'R,2'R)-7'-chloro-2'-(3-chlorophenyl)-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc2c(c1)C=CC1N2[C@@H](C(=O)c2ccccc2)[C@@H]([C@@]21C(=O)c1c(C2=O)cccc1)c1cccc(c1)Cl
STL007897
Synonyms: 1-(4-bromophenyl)-1'-methyl-6'-nitro-2'-phenyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: Brc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N(C2c1ccccc1)C)[N+](=O)[O-]
STL007898
Synonyms: (5E)-1-benzyl-5-(1-{[4-(diethylamino)phenyl]amino}ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCN(c1ccc(cc1)N/C(=C/1\C(=O)NC(=O)N(C1=O)Cc1ccccc1)/C)CC
STL007899
Synonyms: 6-(4-methoxybenzyl)-1-(2-methylphenyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)CN1CNc2c(C1)c(=O)[nH]c(=S)n2c1ccccc1C
STL007900
Synonyms: 8-(4-benzylpiperazin-1-yl)-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccccc1)COc1ccccc1
STL007901
Synonyms: 4-[(3S,3a'R,8a'S,8b'S)-5-chloro-7-methyl-1',2,3'-trioxo-1,1',2,3',3a',6',7',8',8a',8b'-decahydro-2'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizin]-2'-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2C
STL007902
Synonyms: 1,3-dimethyl-7'-({(Z)-[1-(4-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL007903
Synonyms: 1'-(2,2-dimethoxyethyl)-1-(4-methylphenyl)-6'-nitro-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: COC(CN1CC2(Cc3c1ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C2=O)c1ccc(cc1)C)OC
STL007904
Synonyms: (1'R,2'R)-7'-chloro-2'-[4-(propan-2-yl)phenyl]-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc2c(c1)C=CC1N2[C@@H](C(=O)c2cccs2)[C@@H]([C@@]21C(=O)c1c(C2=O)cccc1)c1ccc(cc1)C(C)C
STL007905
Synonyms: 4-[(2E)-3-(furan-2-yl)prop-2-enoyl]-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-5-(pyridin-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccccn1)CCCN1CCOCC1)/C=C/c1ccco1
STL007906
Synonyms: 3-(4-chlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-4-(4-hydroxy-3-methoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: COc1cc(ccc1O)C1CC(=O)Nc2c1c(nn2c1nc(C)cc(n1)C)c1ccc(cc1)Cl
STL007907
Synonyms: (2-{[(2Z)-3-(3-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-2-oxoethoxy)aceticacid
Smiles: OC(=O)COCC(=O)/N=C/1\SC2C(N1c1cccc(c1)F)CS(=O)(=O)C2
STL007908
Synonyms: 9-(2,3-dimethoxyphenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1cccc(c1OC)C1C2=C(CC(CC2=O)c2ccccc2)Nc2n1ncn2
STL007909
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-(2-fluorophenyl)-3-hydroxy-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=C(C(N1c1nnc(s1)SCc1cccc2c1cccc2)c1ccccc1F)C(=O)c1ccc2c(c1)OCCO2)O
STL007910
Synonyms: N-{[(2S)-3-oxo-2-(propan-2-yl)-3,4-dihydroquinoxalin-1(2H)-yl]carbonyl}-L-valyl-L-phenylalanine
Smiles: CC([C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)N1[C@@H](C(C)C)C(=O)Nc2c1cccc2)C
STL007912
Synonyms: 2-[(7-oxo-3-phenyl-2-thioxo-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]acetamide
Smiles: NC(=O)CSc1[nH]c(=O)c2c(n1)n(c1ccccc1)c(=S)s2
STL007913
Synonyms: N-[(2-hydroxyquinolin-3-yl)methyl]-4-methoxy-N-(2-methylpropyl)benzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2ccccc2nc1O)CC(C)C
STL007914
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(4-acetylphenyl)-7-chloro-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2ccc(cc2)C(=O)C)C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1cccc2Cl
STL007915
Synonyms: (1'R,2'R)-1'-[(4-chlorophenyl)carbonyl]-2'-(2,3-dimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1OC)[C@H]1[C@H](C(=O)c2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL007917
Synonyms: 1-(2-chlorophenyl)-6-cyclopentyl-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Clc1ccccc1n1c(=S)[nH]c(=O)c2c1NCN(C2)C1CCCC1
STL007918
Synonyms: 8-[4-(2-chlorobenzyl)piperazin-1-yl]-3-methyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccccc1Cl)C
STL007919
Synonyms: 5-(3,4-dimethoxyphenyl)-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1OC)C1N(CCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(c(c1)F)OC(C)C)O
STL007921
Synonyms: (1'R,2'R)-2'-(2,3-dimethoxyphenyl)-1'-(2,2-dimethylpropanoyl)-7'-fluoro-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1OC)[C@H]1[C@@H](N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)F)C(=O)C(C)(C)C
STL007922
Synonyms: 2-{4-[7-(2-chlorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C
STL007923
Synonyms: N-(1,3-benzothiazol-2-yl)quinoxaline-6-carboxamide
Smiles: O=C(c1ccc2c(c1)nccn2)Nc1nc2c(s1)cccc2
STL007924
Synonyms: 3-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}quinazoline-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)CCn1c(=O)[nH]c2c(c1=O)cccc2
STL007925
Synonyms: N-(3-acetylphenyl)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2)Nc1cccc(c1)C(=O)C
STL007926
Synonyms: 2-cyano-N-[(2Z)-3-(4-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1)F)CS(=O)(=O)C2
STL007927
Synonyms: 1-(4,6-dimethylpyrimidin-2-yl)-4-(3-fluorophenyl)-3-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1CC(c2cccc(c2)F)c2c(N1)n(nc2c1ccccc1)c1nc(C)cc(n1)C
STL007928
Synonyms: 3-methyl-7-(2-methylpropyl)-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(CN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C)C
STL007929
Synonyms: ethyl(6,6-dimethyl-2,4-dioxo-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)acetate
Smiles: CCOC(=O)Cn1c(=O)[nH]c2c(c1=O)c1CC(C)(C)OCc1s2
STL007930
Synonyms: 1-(2,3-dimethylphenyl)-4-(2,4-dimethylphenyl)-3-phenylpiperazine-2,5-dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)CN(C(=O)C1c1ccccc1)c1cccc(c1C)C
STL007931
Synonyms: (1'R,2'R)-7'-chloro-2'-(2,3-dimethoxyphenyl)-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1OC)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl
STL007932
Synonyms: 1-methyl-7-[(3-methylphenoxy)methyl]-6,7-dihydro[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: Cc1cccc(c1)OCC1Cn2c(O1)nc1c2c(=O)[nH]c(=O)n1C
STL007933
Synonyms: ethyl(2,4-dioxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl)acetate
Smiles: CCOC(=O)Cn1c(=O)[nH]c2c(c1=O)c1CCCCc1s2
STL007935
Synonyms: 6-(2-chlorobenzyl)-1-(2-chlorophenyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Clc1ccccc1CN1CNc2c(C1)c(=O)[nH]c(=S)n2c1ccccc1Cl
STL007937
Synonyms: (3R)-2,2-dimethyl-N-[(1S)-2-{[3-(morpholin-4-yl)propyl]amino}-2-oxo-1-phenylethyl]-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@H](c1ccccc1)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)NCCCN1CCOCC1
STL007938
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(2-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1cc(C)c2c(c1)sc(n2)N1C(=O)C(=C(C1c1ccccc1F)C(=O)c1ccc2c(c1)OCCO2)O
STL007939
Synonyms: 2-(methoxymethyl)-3-phenyl-4,5,6,7-tetrahydro-8H-cyclopenta[d]pyrazolo[1,5-a]pyrimidin-8-one
Smiles: COCc1nn2c(c1c1ccccc1)[nH]c1c(c2=O)CCC1
STL007940
Synonyms: (5E)-5-(1-{[4-(dimethylamino)phenyl]amino}propylidene)-1-(2-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CC/C(=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1C)/Nc1ccc(cc1)N(C)C
STL007941
Synonyms: N-(4-fluorophenyl)-5-methyl-2-(methylsulfanyl)-7-(2,3,4-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1c(OC)c(OC)ccc1C1C(=C(C)Nc2n1nc(n2)SC)C(=O)Nc1ccc(cc1)F
STL007942
Synonyms: 7'-{[(E)-(1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CCN1C(=O)NC(=O)/C(=C\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL007943
Synonyms: (5Z)-1-(4-chlorophenyl)-5-[5-(2,4-dimethoxyphenyl)pyrazolidin-3-ylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(c(c1)OC)C1NN/C(=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)/C1
STL007944
Synonyms: 7-(4-fluorobenzyl)-8-{(2E)-2-[1-(2-hydroxyphenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)Cn1c(N/N=C(/c2ccccc2O)\C)nc2c1c(=O)[nH]c(=O)n2C
STL007945
Synonyms: 3-methyl-8-{[(Z)-(2,4,6-trioxo-1-propyltetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCCN1C(=O)NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=O)NC(=O)NC2=O)/C1=O
STL007946
Synonyms: 1-(2-methylprop-2-en-1-yl)-6-(2-phenylethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CC(=C)Cn1c(=S)[nH]c(=O)c2c1NCN(C2)CCc1ccccc1
STL007947
Synonyms: 1'-(2-chlorobenzyl)-1,2,3,4,5,5a-hexahydro-2'H,7H,8H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2-a]azepine-6,5'-pyrimidine]-2',4',6',8(1'H,3'H)-tetrone
Smiles: O=C1NC(=O)C2(C(=O)N1Cc1ccccc1Cl)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2
STL007948
Synonyms: 7-(2,4-dichlorobenzyl)-3-methyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(c(c1)Cl)Cn1c(CN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C
STL007949
Synonyms: 1'-benzyl-15,16-dihydro-2'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: O=C1NC(=O)C2(C(=O)N1Cc1ccccc1)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2
STL007950
Synonyms: (3R)-N-[(2S)-3-(1H-indol-3-yl)-1-{[3-(morpholin-4-yl)propyl]amino}-1-oxopropan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1c[nH]c2c1cccc2)NCCCN1CCOCC1
STL007951
Synonyms: N-[(2Z)-3-(4-acetylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-cyanoacetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1)C(=O)C)CS(=O)(=O)C2
STL007952
Synonyms: 8-(2-methoxy-5-methylphenyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1n1c2nc3c(n2c(c1C)C)c(=O)[nH]c(=O)n3C)C
STL007953
Synonyms: 1'-(2-phenylethyl)-15,16-dihydro-2'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: O=C1NC(=O)C2(C(=O)N1CCc1ccccc1)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2
STL007954
Synonyms: 9-(3-methylphenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: Cc1cccc(c1)C1C2=C(CC(CC2=O)c2ccccc2)Nc2n1ncn2
STL007955
Synonyms: 1'-(2,2-dimethoxyethyl)-1-(2,4-dimethylphenyl)-6'-nitro-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: COC(CN1CC2(Cc3c1ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C2=O)c1ccc(cc1C)C)OC
STL007956
Synonyms: 7-[2-hydroxy-3-(4-methylphenoxy)propyl]-8-[(3-methoxypropyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCCNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(=O)[nH]c(=O)n2C
STL007957
Synonyms: 5-{2-[7-(2-hydroxy-2-phenylethyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazinylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(=NNc2nc3c(n2CC(c2ccccc2)O)c(=O)[nH]c(=O)n3C)C(=O)N1
STL007958
Synonyms: 4-[(3S,3a'R,8a'S,8b'S)-7-chloro-5-methyl-1',2,3'-trioxo-1,1',2,3',3a',6',7',8',8a',8b'-decahydro-2'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizin]-2'-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(C)cc2Cl
STL007959
Synonyms: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(3,4-diethoxyphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cc(ccc1OCC)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL007960
Synonyms: (10'R,11'R)-10'-(2,3-dimethoxyphenyl)-11'-(phenylcarbonyl)-10',11'-dihydro-8a'H-spiro[indene-2,9'-pyrrolo[1,2-a][1,10]phenanthroline]-1,3-dione
Smiles: COc1cccc(c1OC)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2c2ncccc2cc1
STL007963
Synonyms: 1-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1O)C1N(CC(c2cccs2)N(C)C)C(=O)C(=C1C(=O)c1cccs1)O
STL007964
Synonyms: N-[(2Z)-3-(5-chloro-2,4-dimethoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-cyanoacetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1cc(Cl)c(cc1OC)OC)CS(=O)(=O)C2
STL007965
Synonyms: (1'R,2'R)-2'-(3-methoxyphenyl)-1'-[(3-methoxyphenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1cccc(c1)OC)C(=O)c1c(C2=O)cccc1)C
STL007966
Synonyms: N'-[(1Z)-1-(1-cyclohexyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)propyl]pyridine-4-carbohydrazide
Smiles: CC/C(=C/1\C(=O)NC(=O)N(C1=O)C1CCCCC1)/NNC(=O)c1ccncc1
STL007967
Synonyms: 3-methyl-8-({(Z)-[2,4,6-trioxo-1-(prop-2-en-1-yl)tetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: C=CCN1C(=O)NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=O)NC(=O)NC2=O)/C1=O
STL007968
Synonyms: (1'R,2'R)-2'-(4-bromophenyl)-7'-chloro-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Brc1ccc(cc1)[C@H]1[C@H](C(=O)c2cccs2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl
STL007969
Synonyms: 7-(2-fluorobenzyl)-3-methyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccccc1Cn1c(CN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C
STL007970
Synonyms: N-(3-chlorophenyl)-2-(5-oxo-2-phenyl-5,6-dihydro-4H-imidazo[1,2-b][1,2,4]triazol-6-yl)acetamide
Smiles: O=C(CC1C(=O)Nc2n1nc(n2)c1ccccc1)Nc1cccc(c1)Cl
STL007971
Synonyms: 7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(N/N=C/c2ccncc2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)C
STL007972
Synonyms: (5Z)-1-(3-methylphenyl)-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1cccc(c1)N1C(=O)NC(=O)/C(=C/c2cc3CCCN4c3c(c2)CCC4)/C1=O
STL007973
Synonyms: (2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenyl-N-(tetrahydrofuran-2-ylmethyl)propanamide
Smiles: O=c1[nH]c2ccccc2c(=O)n1[C@H](C(=O)NCC1CCCO1)Cc1ccccc1
STL007974
Synonyms: 2-cyano-N-[(2Z)-3-(2,4-dichlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1Cl)Cl)CS(=O)(=O)C2
STL007975
Synonyms: 1'-(3,5-dimethoxybenzyl)-2,4-dimethyl-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1cc(cc(c1)OC)CN1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2C(C)OC(C1)C)[N+](=O)[O-]
STL007976
Synonyms: (1'R,2'R)-7'-chloro-2'-(3-chlorophenyl)-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1cccc(c1)Cl)C(=O)c1c(C2=O)cccc1)Cl
STL007977
Synonyms: 7-(3-chlorobenzyl)-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1cccc(c1)Cl)c(=O)[nH]c(=O)n2C
STL007978
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalanyl-L-asparagine
Smiles: NC(=O)C[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)N1CC(=O)Nc2c1cccc2)Cc1ccccc1
STL007979
Synonyms: 1-(3-chlorophenyl)-6-cyclohexyl-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Clc1cccc(c1)n1c(=S)[nH]c(=O)c2c1NCN(C2)C1CCCCC1
STL007980
Synonyms: methyl{4-[7-(4-chlorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetate
Smiles: COC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)Cl)c(=O)[nH]c(=O)n2C
STL007981
Synonyms: (3R)-N-[(2S)-1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-oxo-3-phenylpropan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: COc1cc(CCNC(=O)[C@@H](NC(=O)[C@H]2N3C(SC2(C)C)c2c(C3=O)cccc2)Cc2ccccc2)ccc1OC
STL007982
Synonyms: 4-chloro-N-[(2-hydroxyquinolin-3-yl)methyl]-N-(2-methoxyethyl)benzamide
Smiles: COCCN(C(=O)c1ccc(cc1)Cl)Cc1cc2ccccc2nc1O
STL007983
Synonyms: 2-(6,6-dimethyl-2,4-dioxo-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)-N-(2-methylpropyl)acetamide
Smiles: CC(CNC(=O)Cn1c(=O)[nH]c2c(c1=O)c1CC(C)(C)OCc1s2)C
STL007984
Synonyms: ethyl8-nitro-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)C1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)NC1=O
STL007985
Synonyms: (1'R,2'S)-1'-[(4-chlorophenyl)carbonyl]-2'-(2,4-dichlorophenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1Cl)Cl)C(=O)c1c(C2=O)cccc1
STL007986
Synonyms: ethyl4-[3-methyl-7-(3-methylbenzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1nc2c(n1Cc1cccc(c1)C)c(=O)[nH]c(=O)n2C
STL007987
Synonyms: (3R)-N-[(2S)-1-{[(2S)-1-hydroxy-3-methylbutan-2-yl]amino}-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: OC[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1c[nH]c2c1cccc2
STL007988
Synonyms: N-(2-methylphenyl)-1-(4-methylphenyl)-4-oxo-2-phenylazetidine-2-carboxamide
Smiles: Cc1ccc(cc1)N1C(=O)CC1(c1ccccc1)C(=O)Nc1ccccc1C
STL007989
Synonyms: N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-4-methoxy-N-(pyridin-3-ylmethyl)benzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2cc(C)ccc2nc1O)Cc1cccnc1
STL007990
Synonyms: 6'-chloro-1,3-dimethyl-7'-[(Z)-(1-methyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1NC(=O)/C(=C/c2ccc3c(c2Cl)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C(=O)N1C
STL007991
Synonyms: 5-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Smiles: COc1cc(ccc1OCc1ccccc1F)C1CC(=O)Nc2c1c(=O)[nH]c(n2)c1ccccc1
STL007992
Synonyms: 3-[4-(dimethylamino)phenyl]-1-(2,3-dimethylphenyl)-4-phenylpiperazine-2,5-dione
Smiles: O=C1CN(C(=O)C(N1c1ccccc1)c1ccc(cc1)N(C)C)c1cccc(c1C)C
STL007993
Synonyms: (3R)-N-[(2S)-1-(cyclopentylamino)-1-oxo-3-phenylpropan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1ccccc1)NC1CCCC1
STL007994
Synonyms: (1'R,2'R)-2'-(3,4-dimethoxyphenyl)-1'-[(3-methoxyphenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1ccc(c(c1)OC)OC)C(=O)c1c(C2=O)cccc1)C
STL007995
Synonyms: 7-(3,4-dichlorobenzyl)-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1ccc(c(c1)Cl)Cl)c(=O)[nH]c(=O)n2C
STL007997
Synonyms: 7-(2-ethoxyphenyl)-N-(4-methoxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: CCOc1ccccc1C1C(=C(C)Nc2n1nnn2)C(=O)Nc1ccc(cc1)OC
STL007998
Synonyms: (5E)-5-[4-(azepan-1-yl)benzylidene]-1-(3-bromophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Brc1cccc(c1)N1C(=S)NC(=O)/C(=C\c2ccc(cc2)N2CCCCCC2)/C1=O
STL007999
Synonyms: 1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: C=CCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008000
Synonyms: (10'R,11'R)-10'-(furan-2-yl)-11'-(phenylcarbonyl)-10',11'-dihydro-8a'H-spiro[indene-2,9'-pyrrolo[1,2-a][1,10]phenanthroline]-1,3-dione
Smiles: O=C([C@@H]1N2c3c(C=CC2[C@@]2([C@H]1c1ccco1)C(=O)c1c(C2=O)cccc1)ccc1c3nccc1)c1ccccc1
STL008001
Synonyms: 2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoicacid
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1C(=O)O
STL008002
Synonyms: 8-[4-(4-fluorobenzyl)piperazin-1-yl]-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccc(cc1)F
STL008003
Synonyms: 3-(2-chlorophenyl)-6-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)pyrimidine-2,4(1H,3H)-dione
Smiles: COc1ccc2c(c1)c1CCNC(c1[nH]2)c1c(O)[nH]c(=O)n(c1=O)c1ccccc1Cl
STL008004
Synonyms: 8-(2-methoxy-5-methylphenyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1n1c(C)cn2c1nc1c2c(=O)[nH]c(=O)n1C)C
STL008006
Synonyms: N-(1-benzylpiperidin-4-yl)-2-[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]propanamide
Smiles: O=C(C(Oc1ccc2c(c1)oc(=O)c(c2C)C)C)NC1CCN(CC1)Cc1ccccc1
STL008007
Synonyms: 2-{4-[7-(2,4-dichlorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)[nH]c(=O)n2C
STL008008
Synonyms: 5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(4-methoxyphenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1OC)C1N(c2ccc(cc2)OC)C(=O)C(=C1C(=O)/C=C/c1ccccc1)O
STL008009
Synonyms: 6-(4-chlorophenyl)-7-(4-fluorophenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nn2c(n1)NC1=C(C2c2ccc(cc2)F)C(Oc2c1cccc2)c1ccc(cc1)Cl
STL008010
Synonyms: (1'R,2'R)-1'-acetyl-7'-chloro-2'-(3-chlorophenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc2c(c1)C=CC1N2[C@@H](C(=O)C)[C@@H]([C@@]21C(=O)c1c(C2=O)cccc1)c1cccc(c1)Cl
STL008011
Synonyms: N-[(2Z)-3-(2,6-diethylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: CCc1cccc(c1N1/C(=N/C(=O)C)/SC2C1CS(=O)(=O)C2)CC
STL008013
Synonyms: 7'-[(E)-{1-[2-(cyclohex-1-en-1-yl)ethyl]-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene}methyl]-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-t
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)CCC1=CCCCC1
STL008014
Synonyms: (1'R,2'R)-7'-chloro-1'-[(3-methoxyphenyl)carbonyl]-2'-[4-(propan-2-yl)phenyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1ccc(cc1)C(C)C)C(=O)c1c(C2=O)cccc1)Cl
STL008015
Synonyms: 2,6-dimethyloctan-2-ol
Smiles: CCC(CCCC(O)(C)C)C
STL008016
Synonyms: 7-ethyl-8-[4-(4-fluorobenzyl)piperazin-1-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccc(cc1)F
STL008018
Synonyms: N-(2,4-difluorophenyl)-6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Smiles: O=C(Nc1ccc(cc1F)F)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008020
Synonyms: N-cyclohexyl-1-(2,4-dimethylphenyl)-4-oxo-2-[4-(propan-2-yl)phenyl]azetidine-2-carboxamide
Smiles: Cc1ccc(c(c1)C)N1C(=O)CC1(C(=O)NC1CCCCC1)c1ccc(cc1)C(C)C
STL008022
Synonyms: 3-(4-chlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-4-(4-hydroxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1CC(c2ccc(cc2)O)c2c(N1)n(nc2c1ccc(cc1)Cl)c1nc(C)cc(n1)C
STL008023
Synonyms: N-[6-(morpholin-4-ylsulfonyl)-1,3-benzothiazol-2-yl]-3-phenylpropanamide
Smiles: O=C(Nc1nc2c(s1)cc(cc2)S(=O)(=O)N1CCOCC1)CCc1ccccc1
STL008024
Synonyms: (2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
Smiles: O=c1[nH]c2ccccc2c(=O)n1[C@H](C(=O)Nc1ccc(cc1)C(F)(F)F)C
STL008025
Synonyms: 8-[4-(2,5-dimethylbenzyl)piperazin-1-yl]-7-ethyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1cc(C)ccc1C
STL008026
Synonyms: 4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-(4-methoxyphenyl)cyclohexanecarboxamide
Smiles: COc1ccc(cc1)NC(=O)C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2
STL008027
Synonyms: 7-(2-ethoxyphenyl)-N-(2-methoxyphenyl)-5-methyl-2-(methylsulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: CCOc1ccccc1C1C(=C(C)Nc2n1nc(n2)SC)C(=O)Nc1ccccc1OC
STL008028
Synonyms: 1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-(3-ethoxy-4-propoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2)Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008029
Synonyms: 7-benzyl-3-methyl-8-[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=C)CN1CCN(CC1)c1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C
STL008030
Synonyms: 3-(1,3-benzodioxol-5-ylmethyl)-1'-butyl-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCCCN1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-]
STL008032
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-valyl-L-serine
Smiles: OC[C@@H](C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)N1CC(=O)Nc2c1cccc2
STL008034
Synonyms: (2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-(1H-indol-3-yl)-N-(tetrahydrofuran-2-ylmethyl)propanamide
Smiles: O=C([C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1c[nH]c2c1cccc2)NCC1CCCO1
STL008035
Synonyms: 7-(4-chlorobenzyl)-3-methyl-8-[4-(3-methylbutyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)Cl)c(=O)[nH]c(=O)n2C)C
STL008036
Synonyms: 5-(3-chlorophenyl)-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1cccc(c1)C1C(=C(C(=O)N1CCN1CCOCC1)O)C(=O)c1ccc(c(c1)F)OC(C)C
STL008037
Synonyms: 5-(2-ethyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-6-hydroxy-3-(4-iodophenyl)pyrimidine-2,4(1H,3H)-dione
Smiles: CCN1CCc2c(C1c1c(O)[nH]c(=O)n(c1=O)c1ccc(cc1)I)[nH]c1c2cccc1
STL008039
Synonyms: (1'R,2'R)-2'-(3-chlorophenyl)-1'-[(4-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1cccc(c1)Cl)C(=O)c1c(C2=O)cccc1
STL008040
Synonyms: 8-[4-(2,4-dichlorobenzyl)piperazin-1-yl]-7-ethyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccc(cc1Cl)Cl
STL008042
Synonyms: [3-(benzylamino)-5-sulfanyl-4H-1,2,4-triazol-4-yl](4-chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)n1c(nnc1S)NCc1ccccc1
STL008043
Synonyms: (5E)-5-[(6-hydroxy-4-oxo-4H-chromen-3-yl)methylidene]-1-phenylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Oc1ccc2c(c1)c(=O)c(co2)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccccc1
STL008044
Synonyms: 4-(4-bromophenyl)-3-[4-(dimethylamino)phenyl]-1-(2,6-dimethylphenyl)piperazine-2,5-dione
Smiles: Brc1ccc(cc1)N1C(=O)CN(C(=O)C1c1ccc(cc1)N(C)C)c1c(C)cccc1C
STL008045
Synonyms: 4-[(4-chlorophenyl)carbonyl]-1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-hydroxy-5-(pyridin-4-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccncc1)C1CCS(=O)(=O)C1
STL008047
Synonyms: N-(2,6-dimethylphenyl)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-4-oxoazetidine-2-carboxamide
Smiles: COc1ccc(cc1)C1(CC(=O)N1c1ccc(cc1)C)C(=O)Nc1c(C)cccc1C
STL008048
Synonyms: 8-(5-chloro-2-methoxyphenyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1n1c2nc3c(n2c(c1C)C)c(=O)[nH]c(=O)n3C)Cl
STL008049
Synonyms: (5Z)-5-(4-chlorobenzylidene)-2-(2-chlorophenyl)-3,5-dihydro-4H-imidazol-4-one
Smiles: Clc1ccc(cc1)/C=C/1\N=C(NC1=O)c1ccccc1Cl
STL008050
Synonyms: (3R)-N-[(2S)-1-(cyclopropylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1c[nH]c2c1cccc2)NC1CC1
STL008052
Synonyms: N-{[(2S)-3-oxo-2-(propan-2-yl)-3,4-dihydroquinoxalin-1(2H)-yl]carbonyl}-L-phenylalanyl-D-methionine
Smiles: CSCC[C@H](C(=O)O)NC(=O)[C@@H](NC(=O)N1[C@@H](C(C)C)C(=O)Nc2c1cccc2)Cc1ccccc1
STL008053
Synonyms: 1'-[2-(4-methoxyphenyl)ethyl]-2,4-dimethyl-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(cc1)CCN1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2C(C)OC(C1)C)[N+](=O)[O-]
STL008055
Synonyms: 7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-[(pyridin-3-ylmethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(NCc2cccnc2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1
STL008056
Synonyms: 8-nitro-2'-thioxo-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H,3'H)-dione
Smiles: S=C1NC(=O)C2(C(=O)N1)Cc1cc(ccc1N1C2CCCC1)[N+](=O)[O-]
STL008057
Synonyms: 5-{[(2Z)-3-(2,6-diethylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-5-oxopentanoicacid
Smiles: CCc1cccc(c1N1/C(=N/C(=O)CCCC(=O)O)/SC2C1CS(=O)(=O)C2)CC
STL008058
Synonyms: N-[3-(dimethylamino)propyl]-2-[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: CN(CCCNC(=O)COc1ccc2c(c1)oc(=O)c(c2C)C)C
STL008059
Synonyms: (1'R,2'R)-7'-chloro-2'-(3,4-dimethoxyphenyl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(cc1OC)[C@H]1[C@H](C(=O)c2cccs2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl
STL008060
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalanyl-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)N1CC(=O)Nc2c1cccc2)Cc1ccccc1
STL008061
Synonyms: 2-[(11aS)-1,3-dioxo-5-[4-(propan-2-yl)phenyl]-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-(furan-2-ylmethyl)benzamide
Smiles: CC(c1ccc(cc1)C1N2[C@@H](Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)NCc1ccco1)C
STL008062
Synonyms: N-(2,4-dimethoxyphenyl)-6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Smiles: COc1ccc(c(c1)OC)NC(=O)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008063
Synonyms: 5-(3,4-dimethoxyphenyl)-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1OC)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(c(c1)F)OC(C)C)O
STL008064
Synonyms: 1-(4-ethoxyphenyl)-3-hydroxy-5-phenyl-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)N1C(c2ccccc2)C(=C(C1=O)O)C(=O)/C=C/c1ccccc1
STL008065
Synonyms: 5-(2,3-dimethoxyphenyl)-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cccc(c1OC)C1C(=C(C(=O)N1CCN1CCOCC1)O)C(=O)c1ccc(c(c1)F)OC(C)C
STL008066
Synonyms: 1-(4,6-dimethylpyrimidin-2-yl)-3,4-diphenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1CC(c2ccccc2)c2c(N1)n(nc2c1ccccc1)c1nc(C)cc(n1)C
STL008068
Synonyms: 7'-{(E)-[1-(2,3-dimethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)c1cccc(c1C)C
STL008070
Synonyms: 7-(4-chlorobenzyl)-8-(4-ethylpiperazin-1-yl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)Cl)c(=O)[nH]c(=O)n2C
STL008071
Synonyms: 1'-butyl-1-(2-chlorophenyl)-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCCN1c2ccc(cc2CC2(C1CCC)C(=O)NC(=O)N(C2=O)c1ccccc1Cl)[N+](=O)[O-]
STL008072
Synonyms: 3-methyl-7-(2-methylprop-2-en-1-yl)-8-[4-(2-phenylethyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=C)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CCc1ccccc1
STL008073
Synonyms: 1-(4-bromophenyl)-5-(2-fluorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Brc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1F)C(=O)c1ccccc1)O
STL008074
Synonyms: 7'-{(E)-[1-(2-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)c1ccccc1Cl
STL008075
Synonyms: 7-(2-methoxyphenyl)-N-(4-methoxyphenyl)-5-methyl-2-(methylsulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1ccccc1C1C(=C(C)Nc2n1nc(n2)SC)C(=O)Nc1ccc(cc1)OC
STL008076
Synonyms: 1,3-dimethyl-7'-[(E)-(2,4,6-trioxo-1-propyltetrahydropyrimidin-5(2H)-ylidene)methyl]-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCN1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL008077
Synonyms: 6-benzyl-1-(2-methylphenyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1ccccc1n1c(=S)[nH]c(=O)c2c1NCN(C2)Cc1ccccc1
STL008079
Synonyms: (5Z)-1-benzyl-5-{[1-(3-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Oc1cccc(c1)n1c(C)cc(c1C)/C=C\1/C(=O)NC(=O)N(C1=O)Cc1ccccc1
STL008080
Synonyms: (1'R,2'R)-2'-(4-bromophenyl)-7'-methyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Brc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C
STL008081
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2-methylphenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2
STL008082
Synonyms: 2-{4-[7-(2-fluorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccccc1F)c(=O)[nH]c(=O)n2C
STL008083
Synonyms: 3-methyl-4-(naphthalen-2-yl)-1-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1CC(c2ccc3c(c2)cccc3)c2c(N1)n(nc2C)c1ccccc1
STL008084
Synonyms: 5-(4-butoxyphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1-(6-methoxy-1,3-benzothiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCOc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)OC)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008085
Synonyms: 4-{4-[(2,5-dichlorophenyl)sulfonyl]piperazin-1-yl}-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide
Smiles: CCCc1nnc(s1)NC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)c1cc(Cl)ccc1Cl
STL008086
Synonyms: 1-(2,3-dimethylphenyl)-6-(1-phenylethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CC(N1CNc2c(C1)c(=O)[nH]c(=S)n2c1cccc(c1C)C)c1ccccc1
STL008087
Synonyms: 4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-5-(4-methylphenyl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(Oc1ccc(cc1F)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)C)CCN1CCOCC1)C
STL008088
Synonyms: (2Z)-3,7-dimethylocta-2,7-dienal
Smiles: C/C(=C/C=O)/CCCC(=C)C
STL008090
Synonyms: 1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3,4-diethoxyphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cc(ccc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008091
Synonyms: 3-(1,3-benzodioxol-5-ylmethyl)-8-nitro-1'-(propan-2-yl)-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CC(N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-])C
STL008093
Synonyms: 10-(cyclopropylcarbonyl)-3,3-dimethyl-11-(2,3,4-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(c(c1OC)OC)C1C2=C(Nc3c(N1C(=O)C1CC1)cccc3)CC(CC2=O)(C)C
STL008095
Synonyms: 2-(4-chlorophenoxy)-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]acetamide
Smiles: O=C(Nc1nc2c(s1)cc(cc2)S(=O)(=O)N(C)C)COc1ccc(cc1)Cl
STL008096
Synonyms: 1-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-hydroxy-5-(4-hydroxyphenyl)-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Oc1ccc(cc1)C1N(CC(c2cccs2)N(C)C)C(=O)C(=C1C(=O)c1cccs1)O
STL008097
Synonyms: 8-[benzyl(methyl)amino]-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2CCSc1nnnn1c1ccccc1)N(Cc1ccccc1)C
STL008099
Synonyms: 5-(naphthalen-1-yl)-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Smiles: O=C1Nc2nc([nH]c(=O)c2C(C1)c1cccc2c1cccc2)c1ccccc1
STL008100
Synonyms: 7'-{(E)-[1-(2,5-dimethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: Cc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)C
STL008101
Synonyms: 7-(2-chlorobenzyl)-3-methyl-8-[4-(3-methylbutyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCN1CCN(CC1)c1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C)C
STL008102
Synonyms: methylN-{[(2R)-3-oxo-2-(propan-2-yl)-3,4-dihydroquinoxalin-1(2H)-yl]carbonyl}-L-phenylalaninate
Smiles: COC(=O)[C@@H](NC(=O)N1[C@H](C(C)C)C(=O)Nc2c1cccc2)Cc1ccccc1
STL008103
Synonyms: (1Z)-1-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene}-1H-isoindol-3-amine
Smiles: Clc1ccc(cc1)c1csc(n1)N/N=C/1\N=C(c2c1cccc2)N
STL008105
Synonyms: 5-{2-[7-(2-hydroxy-3-phenoxypropyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazinylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: OC(Cn1c(NN=C2C(=O)NC(=O)NC2=O)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1
STL008107
Synonyms: (5Z)-1-(4-methylphenyl)-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=S)NC(=O)/C(=C/c2cc3CCCN4c3c(c2)CCC4)/C1=O
STL008108
Synonyms: 8-(3,4-dihydroisoquinolin-2(1H)-yl)-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)[nH]c(=O)c2c1nc(n2CCSc1nnnn1c1ccccc1)N1CCc2c(C1)cccc2
STL008109
Synonyms: 4-(bicyclo[2.2.1]hept-2-yl)-5-(3-phenyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1C1CC2CC1CC2)c1[nH]nc(c1)c1ccccc1
STL008110
Synonyms: (3R)-N-[(1S)-2-{[(2S)-1-hydroxypropan-2-yl]amino}-2-oxo-1-phenylethyl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: OC[C@@H](NC(=O)[C@H](c1ccccc1)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C
STL008111
Synonyms: 3-methyl-8-[4-(2-phenylethyl)piperazin-1-yl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CCc1ccccc1
STL008112
Synonyms: 1-(3,5-dimethoxybenzyl)-1'-methyl-6'-nitro-2'-phenyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: COc1cc(cc(c1)OC)CN1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N(C2c1ccccc1)C)[N+](=O)[O-]
STL008113
Synonyms: ethyl1'-(4-chlorophenyl)-8-nitro-2',4',6'-trioxo-1,1',2,3',4,4',4a,6'-octahydro-2'H,3H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
STL008115
Synonyms: N-(4-chlorophenyl)-2-[4-oxo-2-(4-phenylpiperazin-1-yl)-4,5-dihydro-1H-imidazol-5-yl]acetamide
Smiles: O=C(CC1NC(=NC1=O)N1CCN(CC1)c1ccccc1)Nc1ccc(cc1)Cl
STL008116
Synonyms: N-[4-(acetylamino)phenyl]-6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008117
Synonyms: 8-[4-(2-fluorobenzyl)piperazin-1-yl]-3-methyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccccc1F)C
STL008118
Synonyms: 6-(2-hydroxyphenyl)-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: Oc1ccccc1C1CC(=O)C2=C(C1)Nc1n(C2c2ccccc2)ncn1
STL008120
Synonyms: 5-(2-ethyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-6-hydroxy-3-(2,4,6-trimethylphenyl)pyrimidine-2,4(1H,3H)-dione
Smiles: CCN1CCc2c(C1c1c(O)[nH]c(=O)n(c1=O)c1c(C)cc(cc1C)C)[nH]c1c2cccc1
STL008121
Synonyms: N-({[(2Z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-D-phenylalanine
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OCC(=O)N[C@@H](C(=O)O)Cc2ccccc2)cc(c1OC)OC
STL008122
Synonyms: (2R)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methoxyethyl)-3-phenylpropanamide
Smiles: COCCNC(=O)[C@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1ccccc1
STL008123
Synonyms: 8-[4-(2,5-dimethylbenzyl)piperazin-1-yl]-3-methyl-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1cc(C)ccc1C)C
STL008124
Synonyms: N-[(2Z)-3-(3-chloro-4-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-cyanoacetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccc(c(c1)Cl)F)CS(=O)(=O)C2
STL008125
Synonyms: N-(3,4-dimethoxyphenyl)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexanecarboxamide
Smiles: COc1ccc(cc1OC)NC(=O)C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2
STL008126
Synonyms: 2-cyano-N-[(2Z)-3-(4-fluorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1Cc1ccc(cc1)F)CS(=O)(=O)C2
STL008127
Synonyms: 7-benzyl-3-methyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)n(c2c1n(Cc1ccccc1)c(n2)CN1CCOCC1)C
STL008128
Synonyms: N-(2-methoxyphenyl)-2-(5-oxo-2-phenyl-5,6-dihydro-4H-imidazo[1,2-b][1,2,4]triazol-6-yl)acetamide
Smiles: COc1ccccc1NC(=O)CC1C(=O)Nc2n1nc(n2)c1ccccc1
STL008130
Synonyms: N-(2,5-dimethoxyphenyl)-6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Smiles: COc1ccc(c(c1)NC(=O)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2)OC
STL008131
Synonyms: 5-(2,3-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-[(2E)-3-(furan-2-yl)prop-2-enoyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1c(OC)cccc1C1N(CCN(C)C)C(=O)C(=C1C(=O)/C=C/c1ccco1)O
STL008132
Synonyms: 3-(4-chlorophenyl)-5-ethyl-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Smiles: CCc1cc(=O)n2c([nH]1)c(c1ccc(cc1)Cl)c(n2)C
STL008133
Synonyms: 2-[(6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
Smiles: O=C(NC1CC(C)(C)NC(C1)(C)C)COc1ccc2c(c1)oc(=O)c1c2CCCC1
STL008134
Synonyms: 9-(4-ethoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)[nH]c(=O)n1C
STL008135
Synonyms: O-methyl-L-tyrosine
Smiles: COc1ccc(cc1)C[C@@H](C(=O)O)N
STL008136
Synonyms: 4-{2-(2-fluorophenyl)-4-hydroxy-3-[(4-nitrophenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzenesulfonamide
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccccc1F)c1ccc(cc1)S(=O)(=O)N)c1ccc(cc1)[N+](=O)[O-]
STL008138
Synonyms: 8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C
STL008139
Synonyms: 1,1'-dimethyl-6'-nitro-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione
Smiles: S=C1NC(=O)C2(C(=O)N1C)CN(C)c1c(C2)cc(cc1)[N+](=O)[O-]
STL008140
Synonyms: 9-ethyl-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCN1CCCn2c1nc1c2c(=O)[nH]c(=O)n1C
STL008141
Synonyms: 8-(4-benzylpiperazin-1-yl)-3-methyl-7-{2-[(4-methylpyrimidin-2-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccnc(n1)SCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccccc1
STL008142
Synonyms: 1'-(2,2-dimethoxyethyl)-6'-nitro-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: COC(CN1CC2(Cc3c1ccc(c3)[N+](=O)[O-])C(=O)NC(=O)NC2=O)OC
STL008143
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-leucyl-L-phenylalanine
Smiles: CC(C[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)N1CC(=O)Nc2c1cccc2)C
STL008144
Synonyms: 9-(3-fluorophenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: Fc1cccc(c1)C1C2=C(CC(CC2=O)c2ccccc2)Nc2n1ncn2
STL008145
Synonyms: 6-phenyl-9-(2,3,4-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1ccc(c(c1OC)OC)C1C2=C(CC(CC2=O)c2ccccc2)Nc2n1ncn2
STL008146
Synonyms: 8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCN1CCN(CC1)c1nc2c(n1CCSc1nnnn1c1ccccc1)c(=O)[nH]c(=O)n2C
STL008147
Synonyms: (10'R,11'R)-10'-(2,5-dimethoxyphenyl)-11'-(phenylcarbonyl)-10',11'-dihydro-8a'H-spiro[indene-2,9'-pyrrolo[1,2-a][1,10]phenanthroline]-1,3-dione
Smiles: COc1ccc(c(c1)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2c2ncccc2cc1)OC
STL008150
Synonyms: 5-(3-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008151
Synonyms: 4-[(2E)-3-(furan-2-yl)prop-2-enoyl]-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-5-(thiophen-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C(C1=C(O)C(=O)N(C1c1cccs1)CCCN1CCOCC1)/C=C/c1ccco1
STL008152
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-valyl-L-asparagine
Smiles: NC(=O)C[C@@H](C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)N1CC(=O)Nc2c1cccc2
STL008154
Synonyms: 1'-butyl-1-(3,5-dimethylphenyl)-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCCN1c2ccc(cc2CC2(C1CCC)C(=O)NC(=O)N(C2=O)c1cc(C)cc(c1)C)[N+](=O)[O-]
STL008155
Synonyms: 8-[4-(2-chloro-6-fluorobenzyl)piperazin-1-yl]-3-methyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1c(F)cccc1Cl)C
STL008156
Synonyms: 1-[2-(dimethylamino)ethyl]-4-[(2E)-3-(furan-2-yl)prop-2-enoyl]-3-hydroxy-5-(pyridin-4-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CN(CCN1C(c2ccncc2)C(=C(C1=O)O)C(=O)/C=C/c1ccco1)C
STL008157
Synonyms: (1'R,2'R)-7'-chloro-2'-(2,3-dimethoxyphenyl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1OC)[C@H]1[C@H](C(=O)c2cccs2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl
STL008158
Synonyms: N-[(2Z)-3-(4-bromo-2-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-cyanoacetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1F)Br)CS(=O)(=O)C2
STL008159
Synonyms: (1'R,2'R)-2'-(2-ethoxyphenyl)-1'-{[4-(2-methylpropyl)phenyl]carbonyl}-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: CCOc1ccccc1[C@H]1[C@H](C(=O)c2ccc(cc2)CC(C)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL008160
Synonyms: 3-methyl-8-[4-(2-methylpropyl)piperazin-1-yl]-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CN1CCN(CC1)c1nc2c(n1CCc1ccccc1)c(=O)[nH]c(=O)n2C)C
STL008161
Synonyms: 3-methyl-7-(3-methylbenzyl)-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(CN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C
STL008162
Synonyms: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]pyridine-3-carboxamide
Smiles: CCN(S(=O)(=O)c1ccc2c(c1)sc(n2)NC(=O)c1cccnc1)CC
STL008163
Synonyms: 8-[(3-ethoxypropyl)amino]-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCOCCCNc1nc2c(n1Cc1cccc(c1)C)c(=O)[nH]c(=O)n2C
STL008164
Synonyms: 2-chloro-N-(2-{6-[(1E)-3-(6-hydroxy-3-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-3-oxoprop-1-en-1-yl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-N-methylbenzamide
Smiles: COc1c(/C=C/C(=O)c2c(O)[nH]c(=O)n(c2=O)C)c(CCN(C(=O)c2ccccc2Cl)C)cc2c1OCO2
STL008165
Synonyms: (1'R,2'R)-1'-[(4-chlorophenyl)carbonyl]-2'-(2-ethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: CCOc1ccccc1[C@H]1[C@H](C(=O)c2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL008166
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-5-(3-hydroxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Oc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008167
Synonyms: 7-(2,5-dimethoxyphenyl)-5-methyl-2-(methylsulfanyl)-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1ccc(c(c1)C1C(=C(C)Nc2n1nc(n2)SC)C(=O)Nc1ccccc1)OC
STL008168
Synonyms: 1'-methyl-6'-nitro-1-(propan-2-yl)-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione
Smiles: CC(N1C(=S)NC(=O)C2(C1=O)CN(C)c1c(C2)cc(cc1)[N+](=O)[O-])C
STL008169
Synonyms: 1'-(2,2-dimethoxyethyl)-1-(3,5-dimethylphenyl)-6'-nitro-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: COC(CN1CC2(Cc3c1ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C2=O)c1cc(C)cc(c1)C)OC
STL008170
Synonyms: N-[3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-5-hydroxytryptophan
Smiles: O=C(NC(C(=O)O)Cc1c[nH]c2c1cc(O)cc2)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C
STL008171
Synonyms: 2-chloro-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(2-methylpropyl)benzamide
Smiles: CC(CN(C(=O)c1ccccc1Cl)Cc1cc2cc(C)ccc2nc1O)C
STL008172
Synonyms: N-[(2Z)-3-(2,5-dichlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methoxyacetamide
Smiles: COCC(=O)/N=C/1\SC2C(N1c1cc(Cl)ccc1Cl)CS(=O)(=O)C2
STL008173
Synonyms: (5E)-2-(2,4-dichlorophenyl)-5-[4-(propan-2-yloxy)benzylidene]-3,5-dihydro-4H-imidazol-4-one
Smiles: CC(Oc1ccc(cc1)/C=C\1/N=C(NC1=O)c1ccc(cc1Cl)Cl)C
STL008174
Synonyms: 7-(2-chlorobenzyl)-8-[(2,6-dimethylmorpholin-4-yl)methyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CN(CC(O1)C)Cc1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C
STL008175
Synonyms: N-(2,4-dimethylphenyl)-5-methyl-2-(methylsulfanyl)-7-(pyridin-3-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: CSc1nc2n(n1)C(c1cccnc1)C(=C(N2)C)C(=O)Nc1ccc(cc1C)C
STL008176
Synonyms: 7-chloro-1'-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(=O)C2(C1=O)Cc1c(Cl)cccc1N1C2CN(C)CC1
STL008177
Synonyms: 3-methyl-7-(4-methylbenzyl)-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)Cn1c(CN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C
STL008178
Synonyms: 4-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1CC(c2ccc3c(c2)OCO3)c2c(N1)n(nc2c1ccc(cc1)Cl)c1nc(C)cc(n1)C
STL008179
Synonyms: 1-(2-methylphenyl)-6-(2-phenylethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1ccccc1n1c(=S)[nH]c(=O)c2c1NCN(C2)CCc1ccccc1
STL008180
Synonyms: (1'R,2'R)-1'-[(4-fluorophenyl)carbonyl]-2'-[4-(trifluoromethyl)phenyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)C(F)(F)F)C(=O)c1c(C2=O)cccc1
STL008181
Synonyms: N-(2,4-dimethoxyphenyl)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexanecarboxamide
Smiles: COc1ccc(c(c1)OC)NC(=O)C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2
STL008182
Synonyms: N-[6-(butylsulfamoyl)-1,3-benzothiazol-2-yl]pyridine-4-carboxamide
Smiles: CCCCNS(=O)(=O)c1ccc2c(c1)sc(n2)NC(=O)c1ccncc1
STL008183
Synonyms: methyl4-{[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)propanoyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)C
STL008184
Synonyms: (1'R,2'R)-2'-(2,3-dimethoxyphenyl)-1'-[(4-fluorophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1OC)[C@H]1[C@H](C(=O)c2ccc(cc2)F)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL008185
Synonyms: 3-hydroxy-5-(4-methoxyphenyl)-1-(3-methylphenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1N(c2cccc(c2)C)C(=O)C(=C1C(=O)/C=C/c1ccccc1)O
STL008186
Synonyms: 6'-chloro-1-cyclopropyl-2-thioxo-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-4,6(1H,3H)-dione
Smiles: S=C1NC(=O)C2(C(=O)N1C1CC1)Cc1c(Cl)cccc1N1C2CCC1
STL008187
Synonyms: N-(4-fluorophenyl)-2-{4-oxo-2-[(4-phenoxyphenyl)amino]-4,5-dihydro-1H-imidazol-5-yl}acetamide
Smiles: O=C(CC1NC(=NC1=O)Nc1ccc(cc1)Oc1ccccc1)Nc1ccc(cc1)F
STL008189
Synonyms: N-(2,4-dichlorophenyl)-6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008190
Synonyms: 2-[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-[3-(morpholin-4-yl)propyl]acetamide
Smiles: O=C(COc1ccc2c(c1)oc(=O)c(c2C)C)NCCCN1CCOCC1
STL008191
Synonyms: 3-methyl-8-[4-(2-methylpropyl)piperazin-1-yl]-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CN1CCN(CC1)c1nc2c(n1Cc1cccc3c1cccc3)c(=O)[nH]c(=O)n2C)C
STL008192
Synonyms: (2S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)propanamide
Smiles: Brc1ccc(c(c1)F)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)C
STL008193
Synonyms: 1-(2,3-dimethylphenyl)-6-(2-phenylethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1cccc(c1C)n1c(=S)[nH]c(=O)c2c1NCN(C2)CCc1ccccc1
STL008194
Synonyms: 1'-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(C)CC1)[N+](=O)[O-]
STL008195
Synonyms: methyl2-[({4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexyl}carbonyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2
STL008196
Synonyms: N-(4-chlorophenyl)-6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Smiles: O=C(Nc1ccc(cc1)Cl)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008197
Synonyms: 9-(2,4-dimethoxyphenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1ccc(c(c1)OC)C1C2=C(CC(CC2=O)c2ccccc2)Nc2n1ncn2
STL008198
Synonyms: 1'-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methoxyphenyl)-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(cc1)N1CCN2C(C1)C1(Cc3c2cccc3)C(=O)NC(=O)N(C1=O)CCc1ccc(c(c1)OC)OC
STL008199
Synonyms: 7-benzyl-8-[4-(4-fluorobenzyl)piperazin-1-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)CN1CCN(CC1)c1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C
STL008200
Synonyms: 5-(furan-2-yl)-4-[(2E)-3-(furan-2-yl)prop-2-enoyl]-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccco1)CCCN1CCOCC1)/C=C/c1ccco1
STL008202
Synonyms: 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide
Smiles: O=C(C(Oc1cc2oc(=O)c3c(c2cc1Cl)CCC3)C)NC1CC(C)(C)NC(C1)(C)C
STL008203
Synonyms: 9-(3-methoxyphenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1cccc(c1)C1C2=C(CC(CC2=O)c2ccccc2)Nc2n1ncn2
STL008204
Synonyms: 8-[4-(4-chlorobenzyl)piperazin-1-yl]-3-methyl-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)CN1CCN(CC1)c1nc2c(n1CC(C)C)c(=O)[nH]c(=O)n2C
STL008205
Synonyms: 8-({(Z)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}amino)-3-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'
Smiles: C=CCN1C(=NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=O)NC(=O)NC2=O)/C1=O)S
STL008206
Synonyms: (5Z)-5-[1-acetyl-5-(4-ethoxyphenyl)pyrazolidin-3-ylidene]-1-(4-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCOc1ccc(cc1)C1C/C(=C/2\C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)/NN1C(=O)C
STL008207
Synonyms: 4-[(2E)-3-(furan-2-yl)prop-2-enoyl]-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-5-(thiophen-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C(C1=C(O)C(=O)N(C1c1cccs1)CCCn1cncc1)/C=C/c1ccco1
STL008208
Synonyms: 2-cyano-N-[(2Z)-3-(2-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccccc1F)CS(=O)(=O)C2
STL008210
Synonyms: 8-({(Z)-[4,6-dioxo-1-(propan-2-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}amino)-3-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)N/C=C\2/C(=O)N=C(N(C2=O)C(C)C)S)C(=O)NC(=O)NC1=O
STL008211
Synonyms: 8-(4-benzylpiperidin-1-yl)-3-methyl-7-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2CCCSc1nnnn1c1ccccc1)N1CCC(CC1)Cc1ccccc1
STL008212
Synonyms: 1-(4-bromophenyl)-N-cyclohexyl-4-oxo-2-[4-(propan-2-yl)phenyl]azetidine-2-carboxamide
Smiles: Brc1ccc(cc1)N1C(=O)CC1(C(=O)NC1CCCCC1)c1ccc(cc1)C(C)C
STL008215
Synonyms: 9-(2,3-dimethoxyphenyl)-6-(2-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1cccc(c1OC)C1C2=C(Nc3n1ncn3)CC(CC2=O)c1ccccc1O
STL008216
Synonyms: 7-(2-hydroxy-2-phenylethyl)-3-methyl-8-{[3-(morpholin-4-yl)propyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(c1ccccc1)Cn1c(NCCCN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C
STL008217
Synonyms: ethyl1'-(4-methoxyphenyl)-8-nitro-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)C1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)c1ccc(cc1)OC
STL008218
Synonyms: 7-(3,4-dichlorobenzyl)-8-(4-ethylpiperazin-1-yl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1Cc1ccc(c(c1)Cl)Cl)c(=O)[nH]c(=O)n2C
STL008219
Synonyms: 3-methyl-7-(2-methylpropyl)-8-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1cccc2c1cccc2)C
STL008220
Synonyms: N-[(2Z)-3-(3-chloro-4-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-cyanoacetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccc(c(c1)Cl)OC)CS(=O)(=O)C2
STL008221
Synonyms: 4-(2,3-dihydro-1H-inden-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1C1CCc2c1cccc2)c1ccncc1
STL008222
Synonyms: 5-(3,4-diethoxyphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cc(ccc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008223
Synonyms: ethyl1'-methyl-8-nitro-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)C1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)C
STL008224
Synonyms: 7-(1,3-benzodioxol-5-yl)-5-methyl-2-(methylsulfanyl)-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: CSc1nn2c(n1)NC(=C(C2c1ccc2c(c1)OCO2)C(=O)Nc1ccccc1)C
STL008225
Synonyms: 7'-({(E)-[1-(butan-2-yl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CCC(N1C(=O)NC(=O)/C(=C\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)C
STL008226
Synonyms: 9-(4-hydroxy-3-methoxyphenyl)-6-(2-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1cc(ccc1O)C1C2=C(Nc3n1ncn3)CC(CC2=O)c1ccccc1O
STL008227
Synonyms: (3R)-N-[(1S)-2-{[(2S)-1-hydroxy-3-methylbutan-2-yl]amino}-2-oxo-1-phenylethyl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: OC[C@H](C(C)C)NC(=O)[C@H](c1ccccc1)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1
STL008228
Synonyms: 3,4,5-trimethoxy-N-[6-(pyrrolidin-1-ylsulfonyl)-1,3-benzothiazol-2-yl]benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)N1CCCC1
STL008233
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-(3-ethoxy-4-propoxyphenyl)-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008234
Synonyms: 4-butyl-N-[5-(butylsulfonyl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide
Smiles: CCCCC1CCC(CC1)C(=O)Nc1nnc(s1)S(=O)(=O)CCCC
STL008235
Synonyms: 1-(furan-2-ylmethyl)-6-(4-methoxybenzyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)CN1CNc2c(C1)c(=O)[nH]c(=S)n2Cc1ccco1
STL008236
Synonyms: 8-nitro-3-propanoyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCC(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)NC1=O
STL008237
Synonyms: (1'R,2'R)-2'-(3-chlorophenyl)-7'-fluoro-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1cccc(c1)Cl)C(=O)c1c(C2=O)cccc1)F
STL008238
Synonyms: 4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-5-(3-methoxyphenyl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cccc(c1)C1C(=C(C(=O)N1CCN1CCOCC1)O)C(=O)c1ccc(c(c1)F)OC(C)C
STL008239
Synonyms: ethyl3-{[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)propanoyl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)C
STL008240
Synonyms: 5-methyl-2-(methylsulfanyl)-N-phenyl-7-(pyridin-3-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: CSc1nn2c(n1)NC(=C(C2c1cccnc1)C(=O)Nc1ccccc1)C
STL008241
Synonyms: (5E)-5-(1-{[4-(dimethylamino)phenyl]amino}ethylidene)-1-(4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C(\Nc2ccc(cc2)N(C)C)/C)/C1=O
STL008242
Synonyms: 3-(1,3-benzodioxol-5-ylmethyl)-1'-(4-fluorophenyl)-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1ccccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2
STL008243
Synonyms: 1'-(4-ethoxyphenyl)-2,4-dimethyl-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCOc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2C(C)OC(C1)C)[N+](=O)[O-]
STL008244
Synonyms: (1'R,2'S)-7'-chloro-2'-(2,4-dichlorophenyl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(c(c1)Cl)[C@H]1[C@H](C(=O)c2cccs2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl
STL008246
Synonyms: (1'R,2'R)-1'-[(4-chlorophenyl)carbonyl]-2'-(2,3-dimethoxyphenyl)-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1OC)[C@H]1[C@H](C(=O)c2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C
STL008247
Synonyms: N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-3-methoxy-N-(2-methylpropyl)benzamide
Smiles: COc1cccc(c1)C(=O)N(Cc1cc2cc(C)ccc2nc1O)CC(C)C
STL008248
Synonyms: 1'-[2-(3,4-dimethoxyphenyl)ethyl]-15,16-dihydro-2'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(=O)C2(C1=O)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2
STL008249
Synonyms: 3-hydroxy-5-(3-methoxyphenyl)-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cccc(c1)C1N(c2nnc(s2)SC)C(=O)C(=C1C(=O)c1ccccc1)O
STL008250
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-[3-ethoxy-4-(pentyloxy)phenyl]-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008251
Synonyms: 4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-5-(3-methoxyphenyl)-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cccc(c1)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(c(c1)F)OC(C)C)O
STL008252
Synonyms: 7-(4-bromobenzyl)-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)Br)c(=O)[nH]c(=O)n2C
STL008253
Synonyms: 1-(2,3-dimethylphenyl)-4-(4-methylphenyl)-3-[4-(propan-2-yl)phenyl]piperazine-2,5-dione
Smiles: Cc1ccc(cc1)N1C(=O)CN(C(=O)C1c1ccc(cc1)C(C)C)c1cccc(c1C)C
STL008254
Synonyms: 7-(2-fluorobenzyl)-3-methyl-8-[4-(3-methylbutyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCN1CCN(CC1)c1nc2c(n1Cc1ccccc1F)c(=O)[nH]c(=O)n2C)C
STL008255
Synonyms: 12-methyl-1'-(2-phenylethyl)-15,16-dihydro-2'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: O=C1NC(=O)C2(C(=O)N1CCc1ccccc1)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C
STL008256
Synonyms: (5Z)-2-(2-bromophenyl)-5-[4-(propan-2-yloxy)benzylidene]-3,5-dihydro-4H-imidazol-4-one
Smiles: CC(Oc1ccc(cc1)/C=C/1\N=C(NC1=O)c1ccccc1Br)C
STL008257
Synonyms: (3R)-N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-(propan-2-ylamino)propan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: CC(NC(=O)[C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1c[nH]c2c1cccc2)C
STL008258
Synonyms: 4-{[(1'R,2'R)-2'-(2,3-dimethoxyphenyl)-1,3-dioxo-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinolin]-1'-yl]carbonyl}phenylacetate
Smiles: COc1cccc(c1OC)[C@H]1[C@H](C(=O)c2ccc(cc2)OC(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL008259
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalanyl-L-glutamine
Smiles: O=C1Nc2ccccc2N(C1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)Cc1ccccc1
STL008261
Synonyms: N-(3-chlorophenyl)-6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Smiles: O=C(Nc1cccc(c1)Cl)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008262
Synonyms: 2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-oxo-4,5-dihydro-1H-imidazol-5-yl]-N-(4-phenoxyphenyl)acetamide
Smiles: O=C(CC1NC(=NC1=O)N1CCc2c(C1)cccc2)Nc1ccc(cc1)Oc1ccccc1
STL008263
Synonyms: 7-(2-chloro-6-fluorobenzyl)-8-[(2,6-dimethylmorpholin-4-yl)methyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1OC(C)CN(C1)Cc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)[nH]c(=O)n2C
STL008264
Synonyms: 6-benzyl-1-(pyridin-3-ylmethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1[nH]c(=S)n(c2c1CN(CN2)Cc1ccccc1)Cc1cccnc1
STL008265
Synonyms: 3-methyl-8-[4-(3-phenylpropyl)piperazin-1-yl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CCCc1ccccc1
STL008267
Synonyms: 1-(4-chlorophenyl)-6-(4-methoxybenzyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)CN1CNc2c(C1)c(=O)[nH]c(=S)n2c1ccc(cc1)Cl
STL008268
Synonyms: 4-[3-(3-phenyl-1H-pyrazol-5-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)n1c(S)nnc1c1[nH]nc(c1)c1ccccc1
STL008269
Synonyms: 1,3-dimethyl-7'-{[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1NC(=O)C(=CNc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)C(=O)N1
STL008270
Synonyms: (10'R,11'R)-11'-acetyl-10'-(2,3-dimethoxyphenyl)-10',11'-dihydro-8a'H-spiro[indene-2,9'-pyrrolo[1,2-a][1,10]phenanthroline]-1,3-dione
Smiles: COc1cccc(c1OC)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2c2ncccc2cc1
STL008271
Synonyms: (1'R,2'R)-7'-chloro-2'-(3-chlorophenyl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc2c(c1)C=CC1N2[C@@H](C(=O)c2cccs2)[C@@H]([C@@]21C(=O)c1c(C2=O)cccc1)c1cccc(c1)Cl
STL008272
Synonyms: 2-cyano-N-[(2Z)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccccc1)CS(=O)(=O)C2
STL008273
Synonyms: (5E)-2-(2-chlorophenyl)-5-[4-(propan-2-yloxy)benzylidene]-3,5-dihydro-4H-imidazol-4-one
Smiles: CC(Oc1ccc(cc1)/C=C\1/N=C(NC1=O)c1ccccc1Cl)C
STL008274
Synonyms: 3-methyl-8-(morpholin-4-ylmethyl)-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCCc1ccccc1)c(n2)CN1CCOCC1)C
STL008275
Synonyms: 3-methyl-7-(3-methylbutyl)-8-[4-(3-phenylpropyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CCCc1ccccc1)C
STL008276
Synonyms: (1'R,2'R)-2'-(3-chlorophenyl)-1'-[(2-chlorophenyl)carbonyl]-7'-fluoro-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Fc1ccc2c(c1)C=CC1N2[C@@H](C(=O)c2ccccc2Cl)[C@@H]([C@@]21C(=O)c1c(C2=O)cccc1)c1cccc(c1)Cl
STL008277
Synonyms: 9-(3-chlorophenyl)-6-(2-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: Clc1cccc(c1)C1C2=C(Nc3n1ncn3)CC(CC2=O)c1ccccc1O
STL008278
Synonyms: 7-[(4-ethylphenoxy)methyl]-1-methyl-6,7-dihydro[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: CCc1ccc(cc1)OCC1Cn2c(O1)nc1c2c(=O)[nH]c(=O)n1C
STL008279
Synonyms: 3-acetyl-1',3'-dimethyl-8-{[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1NC(=O)C(=CNc2ccc3c(c2)CC2(C4N3CCN(C4)C(=O)C)C(=O)N(C)C(=O)N(C2=O)C)C(=O)N1
STL008280
Synonyms: 10-(cyclopropylcarbonyl)-11-(3,4-dimethoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(cc1OC)C1C2=C(Nc3c(N1C(=O)C1CC1)cccc3)CC(CC2=O)(C)C
STL008281
Synonyms: ethyl3-{[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)Cn1c(=O)[nH]c2c(c1=O)cccc2
STL008282
Synonyms: 1'-cyclopropyl-3-methyl-8-nitro-2'-thioxo-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H,3'H)-dione
Smiles: CC1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=S)N(C1=O)C1CC1
STL008283
Synonyms: ethyl1'-benzyl-8-nitro-2',4',6'-trioxo-1,1',2,3',4,4',4a,6'-octahydro-2'H,3H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)Cc1ccccc1
STL008284
Synonyms: 2-{4-[7-(4-chlorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)Cl)c(=O)[nH]c(=O)n2C
STL008286
Synonyms: 8-{[(E)-(1-methyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-3-phenyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1NC(=O)C2(C(=O)N1)Cc1cc(N/C=C/3\C(=O)NC(=O)N(C3=O)C)ccc1N1C2CN(CC1)c1ccccc1
STL008287
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide
Smiles: CCCc1nnc(s1)NC(=O)CCC(=O)N1CCN(CC1)C(c1ccccc1)c1ccccc1
STL008288
Synonyms: 7-(4-fluorobenzyl)-3-methyl-8-[4-(3-methylbutyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)F)c(=O)[nH]c(=O)n2C)C
STL008289
Synonyms: N-(2,6-dimethylphenyl)-1-(4-methoxyphenyl)-4-oxo-2-(thiophen-2-yl)azetidine-2-carboxamide
Smiles: COc1ccc(cc1)N1C(=O)CC1(c1cccs1)C(=O)Nc1c(C)cccc1C
STL008290
Synonyms: 8-[4-(4-fluorobenzyl)piperazin-1-yl]-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)CN1CCN(CC1)c1nc2c(n1CC(=C)C)c(=O)[nH]c(=O)n2C
STL008291
Synonyms: 2-hydroxy-N'-{(1Z)-1-[1-(2-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]ethyl}benzohydrazide
Smiles: C/C(=C/1\C(=O)NC(=O)N(C1=O)c1ccccc1C)/NNC(=O)c1ccccc1O
STL008293
Synonyms: 2-{4-[7-(3,4-dichlorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccc(c(c1)Cl)Cl)c(=O)[nH]c(=O)n2C
STL008294
Synonyms: 4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-(3-methoxyphenyl)cyclohexanecarboxamide
Smiles: COc1cccc(c1)NC(=O)C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2
STL008295
Synonyms: 7-(2-chloro-6-fluorobenzyl)-3-methyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1cccc(c1Cn1c(CN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C)Cl
STL008296
Synonyms: 7-(2-chloro-6-fluorobenzyl)-8-(4-ethylpiperazin-1-yl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1Cc1c(F)cccc1Cl)c(=O)[nH]c(=O)n2C
STL008297
Synonyms: (1'R,2'R)-7'-chloro-2'-(3-methoxyphenyl)-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1cccc(c1)OC)C(=O)c1c(C2=O)cccc1)Cl
STL008298
Synonyms: 2-(6,6-dimethyl-2,4-dioxo-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)-N-(2-methoxyethyl)acetamide
Smiles: COCCNC(=O)Cn1c(=O)[nH]c2c(c1=O)c1CC(C)(C)OCc1s2
STL008299
Synonyms: methyl4-{[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)acetyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)Cn1c(=O)[nH]c2c(c1=O)cccc2
STL008300
Synonyms: 7-(3,4-dichlorobenzyl)-3-methyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1Cl)Cn1c(CN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C
STL008301
Synonyms: 2-(2,4-dioxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl)-N-(furan-2-ylmethyl)acetamide
Smiles: O=C(Cn1c(=O)[nH]c2c(c1=O)c1CCCCc1s2)NCc1ccco1
STL008302
Synonyms: methyl{4-[7-(3-chlorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetate
Smiles: COC(=O)CN1CCN(CC1)c1nc2c(n1Cc1cccc(c1)Cl)c(=O)[nH]c(=O)n2C
STL008304
Synonyms: 1,9-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CN1CCCn2c1nc1c2c(=O)[nH]c(=O)n1C
STL008305
Synonyms: 7-(2-hydroxy-2-phenylethyl)-8-{(2E)-2-[1-(2-hydroxyphenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(c1ccccc1)Cn1c(N/N=C(/c2ccccc2O)\C)nc2c1c(=O)[nH]c(=O)n2C
STL008306
Synonyms: 8-{[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-3-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)NC=C2C(=O)N(C)C(=O)N(C2=O)C)C(=O)NC(=O)NC1=O
STL008307
Synonyms: N-{7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}phenylalanine
Smiles: OC(Cn1c(NC(C(=O)O)Cc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)C
STL008308
Synonyms: 1,3-dimethyl-7'-({(Z)-[1-(3-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: Cc1cccc(c1)N1C(=O)NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL008309
Synonyms: ethyl1'-(4-chlorophenyl)-8-nitro-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)C1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
STL008310
Synonyms: (5Z)-1-(4-chlorophenyl)-5-[5-(4-hydroxy-3-methoxyphenyl)pyrazolidin-3-ylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1cc(ccc1O)C1NN/C(=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)/C1
STL008311
Synonyms: 1'-(4-methylbenzyl)-15,16-dihydro-2'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: Cc1ccc(cc1)CN1C(=O)NC(=O)C2(C1=O)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2
STL008312
Synonyms: (5E)-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)-2-thioxo-1-[3-(trifluoromethyl)phenyl]dihydropyrimidine-4,6(1H,5H)-dione
Smiles: O=C1NC(=S)N(C(=O)/C/1=C/c1cc2CCCN3c2c(c1)CCC3)c1cccc(c1)C(F)(F)F
STL008313
Synonyms: 3-butyl-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: CCCCn1c(=S)[nH]c(c(c1=O)C1N(C)CCc2c1c(OC)c1c(c2)OCO1)O
STL008315
Synonyms: 1,3-dimethyl-7'-{[(E)-(2,4,6-trioxo-1-propyltetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCN1C(=O)NC(=O)/C(=C\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL008316
Synonyms: 1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1N(c2nnc(s2)SCc2ccc(cc2)Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008317
Synonyms: N-{[(2S)-3-oxo-2-(propan-2-yl)-3,4-dihydroquinoxalin-1(2H)-yl]carbonyl}-L-valyl-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)N1[C@@H](C(C)C)C(=O)Nc2c1cccc2)C
STL008318
Synonyms: 4-[(2E)-3-(furan-2-yl)prop-2-enoyl]-3-hydroxy-5-(pyridin-3-yl)-1-(pyridin-3-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C(C1=C(O)C(=O)N(C1c1cccnc1)Cc1cccnc1)/C=C/c1ccco1
STL008319
Synonyms: 7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-8-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(N/N=C/c2cccnc2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)C
STL008321
Synonyms: 7'-{(E)-[1-(4-fluorobenzyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: Fc1ccc(cc1)CN1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL008322
Synonyms: 2-(2,4-dioxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl)-N-(3-methoxypropyl)acetamide
Smiles: COCCCNC(=O)Cn1c(=O)[nH]c2c(c1=O)c1CCCCc1s2
STL008323
Synonyms: 1-(4,6-dimethylpyrimidin-2-yl)-3-phenyl-4-(thiophen-2-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1CC(c2cccs2)c2c(N1)n(nc2c1ccccc1)c1nc(C)cc(n1)C
STL008324
Synonyms: 5-(3,4-diethoxyphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1-(6-methoxy-1,3-benzothiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cc(ccc1OCC)C1N(c2nc3c(s2)cc(cc3)OC)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008326
Synonyms: 1,3-dimethyl-7'-{(E)-[2,4,6-trioxo-1-(4-phenylbutan-2-yl)tetrahydropyrimidin-5(2H)-ylidene]methyl}-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)C(CCc1ccccc1)C
STL008327
Synonyms: N-[3-(dimethylamino)propyl]-2-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetamide
Smiles: CN(CCCNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C)C
STL008328
Synonyms: N-{[(2S)-3-oxo-2-(propan-2-yl)-3,4-dihydroquinoxalin-1(2H)-yl]carbonyl}-L-phenylalanyl-D-phenylalanine
Smiles: O=C([C@@H](NC(=O)N1[C@@H](C(C)C)C(=O)Nc2c1cccc2)Cc1ccccc1)N[C@@H](C(=O)O)Cc1ccccc1
STL008330
Synonyms: (1'R,2'R)-2'-(2,3-dimethoxyphenyl)-1'-[(3-methoxyphenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1cccc(c1OC)OC)C(=O)c1c(C2=O)cccc1)C
STL008331
Synonyms: (1'R,2'R)-2'-(3-chlorophenyl)-1'-[(4-fluorophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1cccc(c1)[C@H]1[C@H](C(=O)c2ccc(cc2)F)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL008332
Synonyms: 2-[(11aS)-1,3-dioxo-5-[4-(propan-2-yl)phenyl]-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-[2-(morpholin-4-yl)ethyl]benzamide
Smiles: CC(c1ccc(cc1)C1N2[C@@H](Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)NCCN1CCOCC1)C
STL008333
Synonyms: 3-(1,3-benzodioxol-5-ylmethyl)-1'-tert-butyl-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1NC(=O)C2(C(=O)N1C(C)(C)C)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-]
STL008334
Synonyms: 6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-(3-methoxyphenyl)hexanamide
Smiles: COc1cccc(c1)NC(=O)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008335
Synonyms: 7-(2-chloro-6-fluorobenzyl)-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1c(F)cccc1Cl)c(=O)[nH]c(=O)n2C
STL008336
Synonyms: 1-(4-methoxyphenyl)-3-methyl-4-(naphthalen-1-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: COc1ccc(cc1)n1nc(c2c1NC(=O)CC2c1cccc2c1cccc2)C
STL008337
Synonyms: N-(1,3-benzodioxol-5-yl)-2-(5-oxo-2-phenyl-5,6-dihydro-4H-imidazo[1,2-b][1,2,4]triazol-6-yl)acetamide
Smiles: O=C(CC1C(=O)Nc2n1nc(n2)c1ccccc1)Nc1ccc2c(c1)OCO2
STL008338
Synonyms: N-(4-acetylphenyl)-2-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-4,5-dihydro-1H-imidazol-5-yl}acetamide
Smiles: COc1ccc(cc1)N1CCN(CC1)C1=NC(=O)C(N1)CC(=O)Nc1ccc(cc1)C(=O)C
STL008339
Synonyms: 5-(4-tert-butylphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(C)(C)C)C(=C(C1=O)O)C(=O)c1ccc2c(c1)OCCO2
STL008340
Synonyms: 5-(4-chlorophenyl)-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(Oc1ccc(cc1F)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)Cl)CCN1CCOCC1)C
STL008341
Synonyms: N-(2-fluorophenyl)-2-(5-oxo-2-phenyl-5,6-dihydro-4H-imidazo[1,2-b][1,2,4]triazol-6-yl)acetamide
Smiles: O=C(CC1C(=O)Nc2n1nc(n2)c1ccccc1)Nc1ccccc1F
STL008342
Synonyms: 3-butyl-5-(3-butyl-7,9-dichloro-2,4-dioxo-1,3,4,5-tetrahydro-2H-chromeno[2,3-d]pyrimidin-5-yl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: CCCCn1c(=O)[nH]c(=O)c(c1[O-])C1c2cc(Cl)cc(c2Oc2c1c(=O)n(c(=O)[nH]2)CCCC)Cl
STL008343
Synonyms: 5-[4-(benzyloxy)phenyl]-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Smiles: O=C1Nc2nc([nH]c(=O)c2C(C1)c1ccc(cc1)OCc1ccccc1)c1ccccc1
STL008344
Synonyms: 4-fluoro-N-[(2-hydroxyquinolin-3-yl)methyl]-N-(2-methylpropyl)benzamide
Smiles: CC(CN(C(=O)c1ccc(cc1)F)Cc1cc2ccccc2nc1O)C
STL008345
Synonyms: (2S)-[(N-{[(2S)-3-oxo-2-(propan-2-yl)-3,4-dihydroquinoxalin-1(2H)-yl]carbonyl}-L-phenylalanyl)amino](phenyl)ethanoicacid
Smiles: O=C([C@@H](NC(=O)N1[C@@H](C(C)C)C(=O)Nc2c1cccc2)Cc1ccccc1)N[C@@H](c1ccccc1)C(=O)O
STL008346
Synonyms: 3-ethyl-8-({(Z)-[2,4,6-trioxo-1-(propan-2-yl)tetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCN1CCN2C(C1)C1(Cc3c2ccc(c3)N/C=C\2/C(=O)NC(=O)N(C2=O)C(C)C)C(=O)NC(=O)NC1=O
STL008347
Synonyms: 1-[3-(diethylamino)propyl]-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCN(CCCN1C(=O)C(=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)c1ccc(c(c1)F)OC(C)C)O)CC
STL008348
Synonyms: (5E)-2-(2,4-dichlorophenyl)-5-(4-methoxybenzylidene)-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1ccc(cc1)/C=C\1/N=C(NC1=O)c1ccc(cc1Cl)Cl
STL008349
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2)Nc1ccc2c(c1)OCCO2
STL008352
Synonyms: methyl4-[({4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexyl}carbonyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2
STL008353
Synonyms: (5Z)-5-[1-acetyl-5-(4-hydroxy-3-methoxyphenyl)pyrazolidin-3-ylidene]-1-(4-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1cc(ccc1O)C1C/C(=C/2\C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)/NN1C(=O)C
STL008355
Synonyms: 2-{4-[3-methyl-2,6-dioxo-7-(2-phenylethyl)-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1CCc1ccccc1)c(=O)[nH]c(=O)n2C
STL008356
Synonyms: 2-{4-[3-methyl-7-(2-methylprop-2-en-1-yl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: CC(=C)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CC(=O)N
STL008357
Synonyms: 6-benzyl-5-methyl-2-(phenoxymethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Smiles: Cc1[nH]c2c(c3ccccc3)c(nn2c(=O)c1Cc1ccccc1)COc1ccccc1
STL008358
Synonyms: 7-(2,3-dimethoxyphenyl)-N-(2-methoxyphenyl)-5-methyl-2-(methylsulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: CSc1nc2n(n1)C(C(=C(N2)C)C(=O)Nc1ccccc1OC)c1cccc(c1OC)OC
STL008359
Synonyms: (3R)-N-{(2S)-1-[(furan-2-ylmethyl)amino]-1-oxo-3-phenylpropan-2-yl}-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1ccccc1)NCc1ccco1
STL008360
Synonyms: 1-(4-fluorophenyl)-6-(1-phenylethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Fc1ccc(cc1)n1c(=S)[nH]c(=O)c2c1NCN(C2)C(c1ccccc1)C
STL008361
Synonyms: 7'-{(Z)-[1-(2-methoxyphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: COc1ccccc1N1C(=O)NC(=O)/C(=C/c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL008362
Synonyms: 5-(3,4-diethoxyphenyl)-1-[2-(diethylamino)ethyl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cc(ccc1OCC)C1C(=C(C(=O)N1CCN(CC)CC)O)C(=O)c1ccc2c(c1)OCCO2
STL008363
Synonyms: 8-[(2-aminoethyl)amino]-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: NCCNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(=O)[nH]c(=O)n2C
STL008364
Synonyms: (2S)-N-(3-acetylphenyl)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)propanamide
Smiles: CC(=O)c1cccc(c1)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)C
STL008365
Synonyms: 4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-5-(2-methoxyphenyl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccccc1C1C(=C(C(=O)N1CCN1CCOCC1)O)C(=O)c1ccc(c(c1)F)OC(C)C
STL008366
Synonyms: 3-hydroxy-1,5-bis(3-nitrophenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=C(C(N1c1cccc(c1)[N+](=O)[O-])c1cccc(c1)[N+](=O)[O-])C(=O)c1ccccc1)O
STL008367
Synonyms: 4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(cc(c1OC)OC)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(c(c1)F)OC(C)C)O
STL008368
Synonyms: methyl2-{[6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanoyl]amino}benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008369
Synonyms: methyl{4-[3-methyl-7-(2-methylprop-2-en-1-yl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetate
Smiles: COC(=O)CN1CCN(CC1)c1nc2c(n1CC(=C)C)c(=O)[nH]c(=O)n2C
STL008370
Synonyms: (5Z)-1-[4-(propan-2-yl)phenyl]-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1NC(=O)/C(=C/c2cc3CCCN4c3c(c2)CCC4)/C(=O)N1c1ccc(cc1)C(C)C
STL008371
Synonyms: N-(3-chloro-4-methoxyphenyl)-6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Smiles: COc1ccc(cc1Cl)NC(=O)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008372
Synonyms: 7'-{(E)-[1-(4-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL008373
Synonyms: 1-[2-(3,4-dimethoxyphenyl)ethyl]-6-(4-methoxybenzyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)CN1CNc2c(C1)c(=O)[nH]c(=S)n2CCc1ccc(c(c1)OC)OC
STL008374
Synonyms: 5-{4-[(4-methylbenzyl)oxy]phenyl}-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Smiles: O=C1Nc2nc([nH]c(=O)c2C(C1)c1ccc(cc1)OCc1ccc(cc1)C)c1ccccc1
STL008375
Synonyms: 8-bromo-7-{3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methylpropyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C)CSc1nc(C)cc(n1)C
STL008376
Synonyms: 1'-benzyl-12-methyl-15,16-dihydro-2'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: O=C1NC(=O)C2(C(=O)N1Cc1ccccc1)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C
STL008378
Synonyms: (1'R,2'R)-2'-(4-chlorophenyl)-1'-{[4-(2-methylpropyl)phenyl]carbonyl}-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: CC(Cc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)Cl)C(=O)c1c(C2=O)cccc1)C
STL008379
Synonyms: 8-bromo-3-methyl-7-{3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1nnc(s1)SCCCn1c(Br)nc2c1c(=O)[nH]c(=O)n2C
STL008380
Synonyms: 5-{2-[7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazinylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(=NNc2nc3c(n2CC(COc2ccccc2)O)c(=O)n(c(=O)n3C)C)C(=O)N1
STL008381
Synonyms: N-(furan-2-ylmethyl)-N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)N(Cc1cc2ccc(cc2nc1O)C)Cc1ccco1
STL008382
Synonyms: 3-methyl-7-(2-methylprop-2-en-1-yl)-8-[4-(3-phenylpropyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=C)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CCCc1ccccc1
STL008383
Synonyms: (1'R,2'R)-2'-(3-chlorophenyl)-7'-fluoro-1'-[(4-methylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1cccc(c1)[C@H]1[C@H](C(=O)c2ccc(cc2)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)F
STL008384
Synonyms: 5-(2,5-dimethoxyphenyl)-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(c(c1)C1C(=C(C(=O)N1CCCN1CCOCC1)O)C(=O)c1ccc(c(c1)F)OC(C)C)OC
STL008385
Synonyms: 6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-fluorophenyl)hexanamide
Smiles: O=C(Nc1ccccc1F)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008386
Synonyms: 1-[3-(diethylamino)propyl]-5-(2,5-dimethoxyphenyl)-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCN(CCCN1C(=O)C(=C(C1c1cc(OC)ccc1OC)C(=O)c1ccc(c(c1)F)OC(C)C)O)CC
STL008387
Synonyms: 3-methyl-8-[4-(2-methylpropyl)piperazin-1-yl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CN1CCN(CC1)c1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C)C
STL008388
Synonyms: 8-[4-(2-chloro-6-fluorobenzyl)piperazin-1-yl]-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=C)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1c(F)cccc1Cl
STL008389
Synonyms: 7'-[(Z)-(1-heptyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCCCCCN1C(=O)NC(=O)/C(=C/c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL008390
Synonyms: 8-bromo-7-{2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]ethyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cc(C)nc(n1)SCCn1c(Br)nc2c1c(=O)[nH]c(=O)n2C
STL008391
Synonyms: 8-(3-chloro-4-methoxyphenyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1Cl)n1c(C)cn2c1nc1c2c(=O)[nH]c(=O)n1C
STL008392
Synonyms: 4-[(3S,3a'R,8a'S,8b'S)-7-ethyl-1',2,3'-trioxo-1,1',2,3',3a',6',7',8',8a',8b'-decahydro-2'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizin]-2'-yl]phenylacetate
Smiles: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)OC(=O)C
STL008393
Synonyms: (10'R,11'R)-11'-acetyl-10'-(4-bromophenyl)-10',11'-dihydro-8a'H-spiro[indene-2,9'-pyrrolo[1,2-a][1,10]phenanthroline]-1,3-dione
Smiles: Brc1ccc(cc1)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2c2ncccc2cc1
STL008394
Synonyms: (2S)-N-(3,5-dichlorophenyl)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)propanamide
Smiles: Clc1cc(cc(c1)Cl)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)C
STL008395
Synonyms: 1'-(butan-2-yl)-8-nitro-2'-thioxo-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H,3'H)-dione
Smiles: CCC(N1C(=S)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCCC1)[N+](=O)[O-])C
STL008397
Synonyms: 3,5-dimethoxy-N-[6-(methylsulfamoyl)-1,3-benzothiazol-2-yl]benzamide
Smiles: COc1cc(OC)cc(c1)C(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)NC
STL008398
Synonyms: 7'-{[(E)-(1-tert-butyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)C(C)(C)C
STL008401
Synonyms: (1'R,2'R)-7'-chloro-2'-(2-ethoxyphenyl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: CCOc1ccccc1[C@H]1[C@H](C(=O)c2cccs2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl
STL008402
Synonyms: 7-benzyl-8-[(2-methoxyethyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCNc1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C
STL008403
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-leucyl-L-serine
Smiles: OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)N1CC(=O)Nc2c1cccc2)CC(C)C
STL008404
Synonyms: (1'R,2'R)-7'-chloro-2'-(4-chlorophenyl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(cc1)[C@H]1[C@H](C(=O)c2cccs2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl
STL008405
Synonyms: N-[(2Z)-3-(5-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: Clc1ccc(c(c1)N1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2)C
STL008406
Synonyms: 1-cyclopropyl-2-thioxo-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-4,6(1H,3H)-dione
Smiles: S=C1NC(=O)C2(C(=O)N1C1CC1)Cc1ccccc1N1C2CCC1
STL008407
Synonyms: 1-[2-(dimethylamino)ethyl]-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-5-(thiophen-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CN(CCN1C(c2cccs2)C(=C(C1=O)O)C(=O)c1ccc(c(c1)F)OC(C)C)C
STL008408
Synonyms: N-(3,4-dimethoxyphenyl)-6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Smiles: COc1ccc(cc1OC)NC(=O)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008409
Synonyms: 6-cyclohexyl-1-(3-methylphenyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1cccc(c1)n1c(=S)[nH]c(=O)c2c1NCN(C2)C1CCCCC1
STL008410
Synonyms: (1'R,2'R)-2'-(4-methoxyphenyl)-1'-{[4-(2-methylpropyl)phenyl]carbonyl}-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccc(cc2)CC(C)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL008411
Synonyms: 2-{2-[(4-ethylphenyl)amino]-4-oxo-4,5-dihydro-1H-imidazol-5-yl}-N-(4-phenoxyphenyl)acetamide
Smiles: CCc1ccc(cc1)NC1=NC(=O)C(N1)CC(=O)Nc1ccc(cc1)Oc1ccccc1
STL008412
Synonyms: (5E)-5-(1-{[4-(dimethylamino)phenyl]amino}ethylidene)-1-(2-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CN(c1ccc(cc1)N/C(=C/1\C(=O)NC(=O)N(C1=O)c1ccccc1C)/C)C
STL008413
Synonyms: (3R)-N-[(2S)-1-(cyclopropylamino)-1-oxo-3-phenylpropan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1ccccc1)NC1CC1
STL008414
Synonyms: 1'-[2-(3,4-dimethoxyphenyl)ethyl]-1,2,3,4,5,5a-hexahydro-2'H,7H,8H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2-a]azepine-6,5'-pyrimidine]-2',4',6',8(1'H,3'H)-tetrone
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(=O)C2(C1=O)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2
STL008415
Synonyms: 1'-methyl-6'-nitro-2'-phenyl-1-(propan-2-yl)-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione
Smiles: CC(N1C(=S)NC(=O)C2(C1=O)Cc1cc(ccc1N(C2c1ccccc1)C)[N+](=O)[O-])C
STL008416
Synonyms: 7-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1CCSc1nc3c(o1)cccc3)c(=O)[nH]c(=O)n2C
STL008417
Synonyms: (5E)-1-benzyl-5-(1-{[4-(dimethylamino)phenyl]amino}ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CN(c1ccc(cc1)N/C(=C/1\C(=O)NC(=O)N(C1=O)Cc1ccccc1)/C)C
STL008418
Synonyms: 3-hydroxy-1-(4-methylphenyl)-5-(3-nitrophenyl)-4-[(4-nitrophenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)N1C(=O)C(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)c1ccc(cc1)[N+](=O)[O-])O
STL008420
Synonyms: 8-[4-(2-chloro-6-fluorobenzyl)piperazin-1-yl]-7-ethyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1c(F)cccc1Cl
STL008421
Synonyms: ethyl4-({[4-oxo-2-(4-phenylpiperazin-1-yl)-4,5-dihydro-1H-imidazol-5-yl]acetyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CC1NC(=NC1=O)N1CCN(CC1)c1ccccc1
STL008423
Synonyms: 1-(2,3-dimethylphenyl)-4-(4-ethoxyphenyl)-3-(4-methoxyphenyl)piperazine-2,5-dione
Smiles: CCOc1ccc(cc1)N1C(=O)CN(C(=O)C1c1ccc(cc1)OC)c1cccc(c1C)C
STL008424
Synonyms: 7-(2,4-dichlorobenzyl)-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)[nH]c(=O)n2C
STL008425
Synonyms: 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(4-nitrophenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: OCCN1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccc(cc1)[N+](=O)[O-]
STL008426
Synonyms: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[(2E)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)CCn1c(N/N=C\2/C(=O)Nc3c2cccc3)nc2c1c(=O)[nH]c(=O)n2C
STL008427
Synonyms: 3-(4-ethoxyphenyl)-4,5-diphenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Smiles: CCOc1ccc(cc1)c1n[nH]c2c1C(c1ccccc1)N(C2=O)c1ccccc1
STL008428
Synonyms: (3R)-N-[(2S)-1-[(furan-2-ylmethyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1c[nH]c2c1cccc2)NCc1ccco1
STL008429
Synonyms: N-[4-(acetylamino)phenyl]-2-[4-oxo-2-(4-phenylpiperazin-1-yl)-4,5-dihydro-1H-imidazol-5-yl]acetamide
Smiles: O=C(CC1NC(=NC1=O)N1CCN(CC1)c1ccccc1)Nc1ccc(cc1)NC(=O)C
STL008430
Synonyms: 1,7-dimethyl-9-propyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCN1CC(C)Cn2c1nc1c2c(=O)[nH]c(=O)n1C
STL008431
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-valyl-D-valine
Smiles: O=C1Nc2ccccc2N(C1)C(=O)N[C@H](C(=O)N[C@@H](C(=O)O)C(C)C)C(C)C
STL008432
Synonyms: (3aR,6aS)-3-(3,4-dimethoxyphenyl)-5-(2-methoxy-4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1cc(ccc1N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccc(c(c1)OC)OC)[N+](=O)[O-]
STL008433
Synonyms: 6-benzyl-1-(4-methylphenyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1ccc(cc1)n1c(=S)[nH]c(=O)c2c1NCN(C2)Cc1ccccc1
STL008434
Synonyms: (5E)-5-[4-(azepan-1-yl)benzylidene]-1-(3-chlorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Clc1cccc(c1)N1C(=S)NC(=O)/C(=C\c2ccc(cc2)N2CCCCCC2)/C1=O
STL008436
Synonyms: 4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(Oc1ccc(cc1F)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)C(C)C)CCN1CCOCC1)C
STL008437
Synonyms: (1'R,2'R)-2'-(4-fluorophenyl)-1'-{[4-(2-methylpropyl)phenyl]carbonyl}-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: CC(Cc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)F)C(=O)c1c(C2=O)cccc1)C
STL008438
Synonyms: N-(2,6-dimethylphenyl)-2-(4-methoxyphenyl)-4-oxo-1-phenylazetidine-2-carboxamide
Smiles: COc1ccc(cc1)C1(CC(=O)N1c1ccccc1)C(=O)Nc1c(C)cccc1C
STL008439
Synonyms: 3-methyl-8-[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=C)CN1CCN(CC1)c1nc2c(n1CCc1ccccc1)c(=O)[nH]c(=O)n2C
STL008441
Synonyms: N-[6-(piperidin-1-ylsulfonyl)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide
Smiles: O=C(C1CC1)Nc1nc2c(s1)cc(cc2)S(=O)(=O)N1CCCCC1
STL008442
Synonyms: (3R)-2,2-dimethyl-N-[(2S)-1-{[3-(morpholin-4-yl)propyl]amino}-1-oxo-3-phenylpropan-2-yl]-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1ccccc1)NCCCN1CCOCC1
STL008443
Synonyms: 9-(3-chloro-2-methylphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Clc1cccc(c1C)N1CCCn2c1nc1c2c(=O)[nH]c(=O)n1C
STL008444
Synonyms: 3-amino-6-ethyl-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: CCCSc1nnc(s1)NC(=O)c1sc2c(c1N)cc1c(n2)CCC(C1)CC
STL008445
Synonyms: 2-(6,6-dimethyl-2,4-dioxo-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)-N-(3-methoxypropyl)acetamide
Smiles: COCCCNC(=O)Cn1c(=O)[nH]c2c(c1=O)c1CC(C)(C)OCc1s2
STL008446
Synonyms: methyl{4-[7-(2-fluorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetate
Smiles: COC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccccc1F)c(=O)[nH]c(=O)n2C
STL008447
Synonyms: 12-methyl-1'-(4-methylbenzyl)-15,16-dihydro-2'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: Cc1ccc(cc1)CN1C(=O)NC(=O)C2(C1=O)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C
STL008448
Synonyms: 2-chloro-N-[(2Z)-3-[4-(dimethylamino)phenyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: ClCC(=O)/N=C/1\SC2C(N1c1ccc(cc1)N(C)C)CS(=O)(=O)C2
STL008449
Synonyms: 4-{4-[(3-nitrophenyl)sulfonyl]piperazin-1-yl}-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide
Smiles: CCCc1nnc(s1)NC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)c1cccc(c1)[N+](=O)[O-]
STL008452
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalanyl-L-glutamicacid
Smiles: O=C1Nc2ccccc2N(C1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)Cc1ccccc1
STL008453
Synonyms: 7'-nitro-1-(propan-2-yl)-2-thioxo-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-4,6(1H,3H)-dione
Smiles: CC(N1C(=S)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCC1)[N+](=O)[O-])C
STL008454
Synonyms: ethyl4-{2-[bis(6-hydroxy-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)methyl]-4-nitrophenyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1ccc(cc1C(c1c(O)n(C)c(=O)n(c1=O)C)c1c(O)n(C)c(=O)n(c1=O)C)[N+](=O)[O-]
STL008455
Synonyms: 7-(2-fluorobenzyl)-3-methyl-8-[4-(2-methylpropyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CN1CCN(CC1)c1nc2c(n1Cc1ccccc1F)c(=O)[nH]c(=O)n2C)C
STL008456
Synonyms: N-(3,5-dimethoxyphenyl)-6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Smiles: COc1cc(NC(=O)CCCCCn2c(=O)[nH]c3c(c2=O)cccc3)cc(c1)OC
STL008457
Synonyms: 1,3-dimethyl-7'-{[1-(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)ethyl]amino}-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1NC(=O)C(=C(Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)C)C(=O)N1
STL008458
Synonyms: 1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008459
Synonyms: N-[3-(morpholin-4-yl)propyl]-2-[(2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetamide
Smiles: CCCc1cc(=O)oc2c1ccc(c2)OCC(=O)NCCCN1CCOCC1
STL008460
Synonyms: (3R)-N-{(2S)-3-(1H-indol-3-yl)-1-[(2-methylpropyl)amino]-1-oxopropan-2-yl}-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: CC(CNC(=O)[C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1c[nH]c2c1cccc2)C
STL008461
Synonyms: (1'R,2'R)-1'-[(2-chlorophenyl)carbonyl]-2'-(2,4-dimethoxyphenyl)-7'-fluoro-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1)OC)[C@H]1[C@H](C(=O)c2ccccc2Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)F
STL008462
Synonyms: (3R)-N-[(2S)-1-{[(2S)-1-hydroxypropan-2-yl]amino}-1-oxo-3-phenylpropan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: OC[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1ccccc1)C
STL008464
Synonyms: 1-cyclopropyl-7'-nitro-2-thioxo-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-4,6(1H,3H)-dione
Smiles: S=C1NC(=O)C2(C(=O)N1C1CC1)Cc1cc(ccc1N1C2CCC1)[N+](=O)[O-]
STL008465
Synonyms: 8-{(2E)-2-[1-(4-hydroxyphenyl)ethylidene]hydrazinyl}-3-methyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Oc1ccc(cc1)/C(=N/Nc1nc2c(n1Cc1cccc3c1cccc3)c(=O)[nH]c(=O)n2C)/C
STL008466
Synonyms: (3S,3a'R,8a'S,8b'S)-7-ethyl-2'-phenyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1
STL008467
Synonyms: 3-(3-hydroxypropyl)-6,6-dimethyl-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: OCCCn1c(=O)[nH]c2c(c1=O)c1CC(C)(C)OCc1s2
STL008468
Synonyms: 9-(4-ethoxy-3-methoxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: CCOc1ccc(cc1OC)C1C2=C(Nc3n1ncn3)CC(CC2=O)(C)C
STL008469
Synonyms: (1'R,2'R)-1'-[(4-fluorophenyl)carbonyl]-2'-(2,3,4-trimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1OC)OC)[C@H]1[C@H](C(=O)c2ccc(cc2)F)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL008470
Synonyms: 1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-[3-ethoxy-4-(pentyloxy)phenyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008471
Synonyms: 8-(4-benzylpiperidin-1-yl)-7-{2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]ethyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cc(C)nc(n1)SCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCC(CC1)Cc1ccccc1
STL008472
Synonyms: 8-[(diethylamino)methyl]-3-(2,4-dimethoxyphenyl)-7-hydroxy-2H-chromen-2-one
Smiles: CCN(Cc1c(O)ccc2c1oc(=O)c(c2)c1ccc(cc1OC)OC)CC
STL008474
Synonyms: 7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-8-[(2Z)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)OCC(Cn1c(N/N=C/2\C(=O)Nc3c2cccc3)nc2c1c(=O)[nH]c(=O)n2C)O
STL008476
Synonyms: (1'R,2'R)-7'-chloro-2'-(4-fluorophenyl)-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1ccc(cc1)F)C(=O)c1c(C2=O)cccc1)Cl
STL008477
Synonyms: (1'R,2'R)-2'-(4-bromophenyl)-1'-[(3-methoxyphenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1ccc(cc1)Br)C(=O)c1c(C2=O)cccc1)C
STL008478
Synonyms: 7-(2-hydroxy-2-phenylethyl)-3-methyl-8-{[2-(morpholin-4-yl)ethyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(c1ccccc1)Cn1c(NCCN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C
STL008479
Synonyms: N-(3,5-dimethoxyphenyl)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexanecarboxamide
Smiles: COc1cc(cc(c1)OC)NC(=O)C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2
STL008480
Synonyms: (10'R,11'R)-10'-(3,4-dimethoxyphenyl)-11'-(phenylcarbonyl)-10',11'-dihydro-8a'H-spiro[indene-2,9'-pyrrolo[1,2-a][1,10]phenanthroline]-1,3-dione
Smiles: COc1ccc(cc1OC)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2c2ncccc2cc1
STL008481
Synonyms: 1-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-hydroxy-4-(phenylcarbonyl)-5-(pyridin-4-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CN(C(c1cccs1)CN1C(c2ccncc2)C(=C(C1=O)O)C(=O)c1ccccc1)C
STL008482
Synonyms: 1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-(3-hydroxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Oc1cccc(c1)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008483
Synonyms: (1Z)-1-[2-(4-phenyl-1,3-thiazol-2-yl)hydrazinylidene]-1H-isoindol-3-amine
Smiles: NC1=N/C(=N\Nc2scc(n2)c2ccccc2)/c2c1cccc2
STL008484
Synonyms: N-(4-fluorobenzyl)-2-[(11aS)-5-(4-methylphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: Cc1ccc(cc1)C1N2[C@@H](Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)NCc1ccc(cc1)F
STL008485
Synonyms: (1'R,2'R)-2'-(2,3-dimethoxyphenyl)-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1cccc(c1OC)OC)C(=O)c1c(C2=O)cccc1
STL008486
Synonyms: 3,3-dimethyl-10-[(4-methylpiperazin-1-yl)acetyl]-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CN1CCN(CC1)CC(=O)N1c2ccccc2NC2=C(C1c1cccs1)C(=O)CC(C2)(C)C
STL008487
Synonyms: 7-benzyl-8-[4-(2-fluorobenzyl)piperazin-1-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccccc1CN1CCN(CC1)c1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C
STL008488
Synonyms: 5-{2-[7-(4-fluorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazinylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(=NNc2nc3c(n2Cc2ccc(cc2)F)c(=O)[nH]c(=O)n3C)C(=O)N1
STL008489
Synonyms: 4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-5-(4-methoxyphenyl)-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(c(c1)F)OC(C)C)O
STL008490
Synonyms: (1'R,2'R)-2'-(2,5-dimethoxyphenyl)-1'-{[4-(2-methylpropyl)phenyl]carbonyl}-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1)[C@H]1[C@H](C(=O)c2ccc(cc2)CC(C)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1)OC
STL008491
Synonyms: 8-[4-(2-fluorobenzyl)piperazin-1-yl]-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccccc1F
STL008492
Synonyms: 8-(4-benzylpiperazin-1-yl)-3-methyl-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccccc1)C
STL008493
Synonyms: N-(3,5-dichlorophenyl)-2-[2-(morpholin-4-yl)-4-oxo-4,5-dihydro-1H-imidazol-5-yl]acetamide
Smiles: O=C(CC1NC(=NC1=O)N1CCOCC1)Nc1cc(Cl)cc(c1)Cl
STL008494
Synonyms: 6,8-dibromo-N-(4-chlorobenzyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: Clc1ccc(cc1)CNC(=O)c1c(=O)[nH]c2c(c1O)cc(cc2Br)Br
STL008495
Synonyms: N-(4-fluorobenzyl)-4-[(11aS)-5-(3-methoxyphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1cccc(c1)C1N2C(=O)N(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)c1ccc(cc1)C(=O)NCc1ccc(cc1)F
STL008498
Synonyms: methyl{4-[3-methyl-7-(3-methylbutyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetate
Smiles: COC(=O)CN1CCN(CC1)c1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C
STL008499
Synonyms: (5Z)-5-{1-[(2,5-dimethoxyphenyl)amino]ethylidene}-1-(4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(c(c1)N/C(=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)C)/C)OC
STL008500
Synonyms: 3-phenyl-8-{[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1NC(=O)C2(C(=O)N1)Cc1cc(NC=C3C(=O)NC(=O)NC3=O)ccc1N1C2CN(CC1)c1ccccc1
STL008501
Synonyms: N-(1,3-benzothiazol-2-yl)-2,3-dimethyl-1H-indole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)Nc1nc2c(s1)cccc2
STL008502
Synonyms: N-(2-methoxyphenyl)-5-methyl-7-(3-methylphenyl)-2-(methylsulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1ccccc1NC(=O)C1=C(C)Nc2n(C1c1cccc(c1)C)nc(n2)SC
STL008503
Synonyms: 8-[(2E)-2-(2-hydroxy-3-methoxybenzylidene)hydrazinyl]-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cccc(c1O)/C=N/Nc1nc2c(n1CC(COc1ccccc1)O)c(=O)[nH]c(=O)n2C
STL008504
Synonyms: 10-acetyl-11-(3,4-dimethoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(cc1OC)C1C2=C(Nc3c(N1C(=O)C)cccc3)CC(CC2=O)(C)C
STL008505
Synonyms: N-[3-(dimethylamino)propyl]-2-[(4-ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanamide
Smiles: CCc1cc(=O)oc2c1c(cc(c2)C)OC(C(=O)NCCCN(C)C)C
STL008506
Synonyms: 6-(1-phenylethyl)-1-(pyridin-3-ylmethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CC(N1CNc2c(C1)c(=O)[nH]c(=S)n2Cc1cccnc1)c1ccccc1
STL008507
Synonyms: 9-(4-ethoxy-3-methoxyphenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: CCOc1ccc(cc1OC)C1C2=C(CC(CC2=O)c2ccccc2)Nc2n1ncn2
STL008508
Synonyms: 1,3-dimethyl-7'-{(E)-[2,4,6-trioxo-1-(2-phenylethyl)tetrahydropyrimidin-5(2H)-ylidene]methyl}-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)CCc1ccccc1
STL008509
Synonyms: N-[4-(dimethylamino)phenyl]-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexanecarboxamide
Smiles: CN(c1ccc(cc1)NC(=O)C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2)C
STL008510
Synonyms: N-(2-chlorophenyl)-2-(5-oxo-2-phenyl-5,6-dihydro-4H-imidazo[1,2-b][1,2,4]triazol-6-yl)acetamide
Smiles: O=C(CC1C(=O)Nc2n1nc(n2)c1ccccc1)Nc1ccccc1Cl
STL008511
Synonyms: 2-(2,4-dioxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl)-N-(2-methoxyethyl)acetamide
Smiles: COCCNC(=O)Cn1c(=O)[nH]c2c(c1=O)c1CCCCc1s2
STL008512
Synonyms: 5-(2,3-dimethoxyphenyl)-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1c(OC)cccc1C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(c(c1)F)OC(C)C)O
STL008513
Synonyms: 4-[(2E)-3-(furan-2-yl)prop-2-enoyl]-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccc(cc1)C(C)C)CCCn1cncc1)/C=C/c1ccco1
STL008514
Synonyms: 7-ethyl-3-methyl-8-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1cccc2c1cccc2
STL008516
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008517
Synonyms: 3-chloro-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(2-methylpropyl)benzamide
Smiles: CC(CN(C(=O)c1cccc(c1)Cl)Cc1cc2cc(C)ccc2nc1O)C
STL008518
Synonyms: N-[5-(butylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-ethoxybenzamide
Smiles: CCCCS(=O)(=O)c1nnc(s1)NC(=O)c1cccc(c1)OCC
STL008519
Synonyms: 7-(2-chlorobenzyl)-3-methyl-8-[4-(2-methylpropyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CN1CCN(CC1)c1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C)C
STL008520
Synonyms: 8-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-3-methyl-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(CN2CCN(CC2)c2cc(Cl)ccc2C)nc2c1c(=O)[nH]c(=O)n2C)C
STL008521
Synonyms: 6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-(3-fluorophenyl)hexanamide
Smiles: O=C(Nc1cccc(c1)F)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008522
Synonyms: 4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1c(OC)cc(cc1OC)C1C(=C(C(=O)N1CCN1CCOCC1)O)C(=O)c1ccc(c(c1)F)OC(C)C
STL008523
Synonyms: methyl4-(3-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-4-hydroxy-1-[2-(morpholin-4-yl)ethyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1C(=C(C(=O)N1CCN1CCOCC1)O)C(=O)c1ccc(c(c1)F)OC(C)C
STL008524
Synonyms: 7-(2,3-dimethoxyphenyl)-5-methyl-2-(methylsulfanyl)-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1c(OC)cccc1C1C(=C(C)Nc2n1nc(n2)SC)C(=O)Nc1ccccc1
STL008526
Synonyms: 6-(2-chlorobenzyl)-1-(4-chlorophenyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Clc1ccc(cc1)n1c(=S)[nH]c(=O)c2c1NCN(C2)Cc1ccccc1Cl
STL008527
Synonyms: 8-hydrazinyl-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: NNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(=O)[nH]c(=O)n2C
STL008528
Synonyms: (1'R,2'R)-2'-(4-chlorophenyl)-1'-[(4-chlorophenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1ccc(cc1)Cl)C(=O)c1c(C2=O)cccc1)C
STL008529
Synonyms: N-[5-(butylsulfonyl)-1,3,4-thiadiazol-2-yl]-2,4-dichlorobenzamide
Smiles: CCCCS(=O)(=O)c1nnc(s1)NC(=O)c1ccc(cc1Cl)Cl
STL008530
Synonyms: 7-(2,4-dichlorobenzyl)-8-(4-ethylpiperazin-1-yl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)[nH]c(=O)n2C
STL008531
Synonyms: N-(3-acetylphenyl)-6-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
STL008532
Synonyms: N-(3-chloro-2-methylphenyl)-2-(5-oxo-2-phenyl-5,6-dihydro-4H-imidazo[1,2-b][1,2,4]triazol-6-yl)acetamide
Smiles: O=C(Nc1cccc(c1C)Cl)CC1C(=O)Nc2n1nc(n2)c1ccccc1
STL008533
Synonyms: 7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-(4-phenylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)c1ccccc1)COc1ccccc1
STL008535
Synonyms: 3,7-dimethyloct-6-en-1-yn-3-ylacetate
Smiles: C#CC(OC(=O)C)(CCC=C(C)C)C
STL008536
Synonyms: (5E)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1-(5-chloro-2-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\c2cn(c3c2cccc3)Cc2ccccc2)/C1=O)C
STL008538
Synonyms: 7'-[(Z)-(1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CCN1C(=O)NC(=O)/C(=C/c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL008539
Synonyms: 2-chloro-5-[({[5-(4-methylphenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: O=C(Nc1ccc(c(c1)C(=O)O)Cl)CSc1nc2scc(c2c(=O)[nH]1)c1ccc(cc1)C
STL008540
Synonyms: (1'R,2'R)-2'-(2,4-dimethoxyphenyl)-7'-fluoro-1'-[(4-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1ccc(cc1OC)OC)C(=O)c1c(C2=O)cccc1)F
STL008541
Synonyms: (3aR,6aS)-3-(2,3-dimethoxyphenyl)-5-(2-methoxy-5-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1ccc(cc1N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1cccc(c1OC)OC)[N+](=O)[O-]
STL008542
Synonyms: 8-[(dibenzylamino)methyl]-3-methyl-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(CN(Cc2ccccc2)Cc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)C
STL008543
Synonyms: 5-(2-{7-[2-(4-methoxyphenyl)ethyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}hydrazinylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1)CCn1c(NN=C2C(=O)NC(=O)NC2=O)nc2c1c(=O)[nH]c(=O)n2C
STL008544
Synonyms: 4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-5-(2-methoxyphenyl)-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccccc1C1C(=C(C(=O)N1CCCN1CCOCC1)O)C(=O)c1ccc(c(c1)F)OC(C)C
STL008545
Synonyms: 7'-[(Z)-(4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: SC1=NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C(=O)N1
STL008546
Synonyms: N-{7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}phenylalanine
Smiles: Cc1cccc(c1)OCC(Cn1c(NC(C(=O)O)Cc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)O
STL008547
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalanyl-D-phenylalanine
Smiles: O=C1Nc2ccccc2N(C1)C(=O)N[C@H](C(=O)N[C@@H](C(=O)O)Cc1ccccc1)Cc1ccccc1
STL008548
Synonyms: N-(2-methylphenyl)-4-oxo-1-phenyl-2-[4-(propan-2-yl)phenyl]azetidine-2-carboxamide
Smiles: O=C1CC(N1c1ccccc1)(c1ccc(cc1)C(C)C)C(=O)Nc1ccccc1C
STL008549
Synonyms: 5-[2-(4-benzylpiperazin-1-yl)-5-nitrobenzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(=Cc2cc(ccc2N2CCN(CC2)Cc2ccccc2)[N+](=O)[O-])C(=O)N1
STL008550
Synonyms: 3-methyl-8-[4-(3-methylbutyl)piperazin-1-yl]-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCN1CCN(CC1)c1nc2c(n1CCc1ccccc1)c(=O)[nH]c(=O)n2C)C
STL008551
Synonyms: 4-{[(1'R,2'R)-2'-(4-chlorophenyl)-1,3-dioxo-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinolin]-1'-yl]carbonyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)Cl)C(=O)c1c(C2=O)cccc1
STL008552
Synonyms: 7'-{(E)-[1-(3-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: Clc1cccc(c1)N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL008554
Synonyms: 4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-(3-fluorophenyl)cyclohexanecarboxamide
Smiles: Fc1cccc(c1)NC(=O)C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2
STL008555
Synonyms: (2S)-N-(2,4-dichlorophenyl)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)propanamide
Smiles: Clc1ccc(c(c1)Cl)NC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)C
STL008556
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalanyl-D-tryptophan
Smiles: O=C1Nc2ccccc2N(C1)C(=O)N[C@H](C(=O)N[C@@H](C(=O)O)Cc1c[nH]c2c1cccc2)Cc1ccccc1
STL008557
Synonyms: N-[(2Z)-3-(4-chlorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-cyanoacetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1Cc1ccc(cc1)Cl)CS(=O)(=O)C2
STL008558
Synonyms: (5Z)-1-(4-chlorophenyl)-5-{5-[4-(propan-2-yl)phenyl]pyrazolidin-3-ylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)NC(=O)/C(=C\2/NNC(C2)c2ccc(cc2)C(C)C)/C1=O
STL008559
Synonyms: 8-(4-benzylpiperidin-1-yl)-7-(4-chlorobenzyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCC(CC1)Cc1ccccc1
STL008560
Synonyms: (1'R,2'R)-1'-(2,2-dimethylpropanoyl)-7'-fluoro-2'-(2,3,4-trimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1OC)OC)[C@H]1[C@@H](N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)F)C(=O)C(C)(C)C
STL008561
Synonyms: 7'-{(E)-[1-(3-fluorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: Fc1cccc(c1)N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL008562
Synonyms: 2-cyano-N-[(2Z)-3-[4-(diethylamino)phenyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1)N(CC)CC)CS(=O)(=O)C2
STL008564
Synonyms: 7-[(3,4-dimethylphenoxy)methyl]-1-methyl-6,7-dihydro[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: Cc1ccc(cc1C)OCC1Cn2c(O1)nc1c2c(=O)[nH]c(=O)n1C
STL008565
Synonyms: 1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-[3-(pentyloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008566
Synonyms: 4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-5-(5-methylfuran-2-yl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(o1)C1C(=C(C(=O)N1CCN1CCOCC1)O)C(=O)c1ccc(c(c1)F)OC(C)C
STL008567
Synonyms: N-(2,5-dimethylphenyl)-2-(5-oxo-2-phenyl-5,6-dihydro-4H-imidazo[1,2-b][1,2,4]triazol-6-yl)acetamide
Smiles: O=C(CC1C(=O)Nc2n1nc(n2)c1ccccc1)Nc1cc(C)ccc1C
STL008568
Synonyms: 3-[(4-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}cyclohexyl)methyl]quinazoline-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)C1CCC(CC1)Cn1c(=O)[nH]c2c(c1=O)cccc2
STL008569
Synonyms: 4-[(2E)-3-(furan-2-yl)prop-2-enoyl]-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-5-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccccc1)CCN1CCOCC1)/C=C/c1ccco1
STL008570
Synonyms: (5Z)-1-(2,5-dimethylphenyl)-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Cc1ccc(c(c1)N1C(=S)NC(=O)/C(=C/c2cc3CCCN4c3c(c2)CCC4)/C1=O)C
STL008571
Synonyms: (1'R,2'R)-2'-(3-methoxyphenyl)-1'-{[4-(2-methylpropyl)phenyl]carbonyl}-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)[C@H]1[C@H](C(=O)c2ccc(cc2)CC(C)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL008572
Synonyms: 3-ethyl-2,10-dihydroxy-15-[(2-methoxyethoxy)methyl]-2,6,8,10,12,17-hexamethyl-5-oxo-9-{[3,4,6-trideoxy-3-(dimethylamino)hexopyranosyl]oxy}-4,16-dioxa-14-azabicyclo[11.3.1]heptadec-7-yl2,6-dideoxy-3-C
Smiles: COCCOCC1NC2C(C)CC(C)(O)C(OC3OC(C)CC(C3O)N(C)C)C(C)C(C(C(=O)OC(C(C(O1)C2C)(C)O)CC)C)OC1OC(C)C(C(C1)(C)OC)O
STL008573
Synonyms: 7-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-8-(4-ethylpiperazin-1-yl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1CCSc1nc3c(o1)cccc3)c(=O)[nH]c(=O)n2C
STL008574
Synonyms: 7'-nitro-2-thioxo-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-4,6(1H,3H)-dione
Smiles: S=C1NC(=O)C2(C(=O)N1)Cc1cc(ccc1N1C2CCC1)[N+](=O)[O-]
STL008575
Synonyms: 4-chloro-N-[(2-hydroxyquinolin-3-yl)methyl]-N-(2-methylpropyl)benzamide
Smiles: CC(CN(C(=O)c1ccc(cc1)Cl)Cc1cc2ccccc2nc1O)C
STL008577
Synonyms: 8-[(diethylamino)methyl]-3-(2,5-dimethoxyphenyl)-7-hydroxy-4-methyl-2H-chromen-2-one
Smiles: CCN(Cc1c(O)ccc2c1oc(=O)c(c2C)c1cc(OC)ccc1OC)CC
STL008578
Synonyms: 1-(4-chlorophenyl)-N-(2,6-dimethylphenyl)-4-oxo-2-phenylazetidine-2-carboxamide
Smiles: Clc1ccc(cc1)N1C(=O)CC1(c1ccccc1)C(=O)Nc1c(C)cccc1C
STL008579
Synonyms: 5-(3,4-diethoxyphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cc(ccc1OCC)C1N(c2nnc(s2)SCc2ccccc2F)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008580
Synonyms: 5-(2,5-dimethoxyphenyl)-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(c(c1)C1C(=C(C(=O)N1CCN1CCOCC1)O)C(=O)c1ccc(c(c1)F)OC(C)C)OC
STL008581
Synonyms: methyl[4-(7-benzyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperazin-1-yl]acetate
Smiles: COC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C
STL008582
Synonyms: 8-bromo-3-methyl-7-[3-(pyrimidin-2-ylsulfanyl)propyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCCSc1ncccn1)c(n2)Br)C
STL008583
Synonyms: 7-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-3-methyl-8-(3-methylpiperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCCN(C1)c1nc2c(n1CCSc1nc3c(o1)cccc3)c(=O)[nH]c(=O)n2C
STL008584
Synonyms: 5-(3-bromophenyl)-1-[3-(dimethylamino)propyl]-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CN(CCCN1C(c2cccc(c2)Br)C(=C(C1=O)O)C(=O)c1ccc(c(c1)F)OC(C)C)C
STL008585
Synonyms: N-[3-(dimethylamino)propyl]-2-[(8-methyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]propanamide
Smiles: CN(CCCNC(=O)C(Oc1ccc2c(c1C)oc(=O)cc2c1ccccc1)C)C
STL008586
Synonyms: 4-(2,4-dimethylphenyl)-1-(2,6-dimethylphenyl)-3-phenylpiperazine-2,5-dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)CN(C(=O)C1c1ccccc1)c1c(C)cccc1C
STL008587
Synonyms: 6-benzyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1cc(ccc1OC)CCn1c(=S)[nH]c(=O)c2c1NCN(C2)Cc1ccccc1
STL008589
Synonyms: 7-[(3-ethylphenoxy)methyl]-1-methyl-6,7-dihydro[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: CCc1cccc(c1)OCC1Cn2c(O1)nc1c2c(=O)[nH]c(=O)n1C
STL008590
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-(3-ethoxyphenyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cccc(c1)C1C(=C(C(=O)N1c1nnc(s1)C)O)C(=O)c1ccc2c(c1)OCCO2
STL008591
Synonyms: 10-acetyl-11-(2,4-dimethoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(c(c1)OC)C1C2=C(Nc3c(N1C(=O)C)cccc3)CC(CC2=O)(C)C
STL008592
Synonyms: methyl2-[(3S,3a'R,8a'S,8b'S)-7-ethyl-1',2,3'-trioxo-1,1',2,3',3a',6',7',8',8a',8b'-decahydro-2'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizin]-2'-yl]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2CC
STL008593
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-hydroxyphenyl)methylidene]-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)O
STL008595
Synonyms: 8-[(2,6-dimethylmorpholin-4-yl)methyl]-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CN(CC(O1)C)Cc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C
STL008596
Synonyms: 2-{4-[7-(4-fluorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)F)c(=O)[nH]c(=O)n2C
STL008597
Synonyms: 5-[(2E)-3-(2,5-dimethoxyphenyl)prop-2-enoyl]-3-(4-ethoxyphenyl)-6-hydroxypyrimidine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)n1c(=O)[nH]c(c(c1=O)C(=O)/C=C/c1cc(OC)ccc1OC)O
STL008598
Synonyms: (5Z)-1-benzyl-5-{[1-(2-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)/C(=C/c2cc(n(c2C)c2ccccc2O)C)/C(=O)N1Cc1ccccc1
STL008600
Synonyms: (1'R,2'R)-2'-(4-bromophenyl)-1'-[(4-fluorophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)Br)C(=O)c1c(C2=O)cccc1
STL008601
Synonyms: 1'-(2-chlorobenzyl)-12-methyl-15,16-dihydro-2'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: O=C1NC(=O)C2(C(=O)N1Cc1ccccc1Cl)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C
STL008602
Synonyms: 4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-5-(4-methoxyphenyl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1C(=C(C(=O)N1CCN1CCOCC1)O)C(=O)c1ccc(c(c1)F)OC(C)C
STL008603
Synonyms: 7-(3-chlorobenzyl)-3-methyl-8-[4-(3-methylbutyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCN1CCN(CC1)c1nc2c(n1Cc1cccc(c1)Cl)c(=O)[nH]c(=O)n2C)C
STL008605
Synonyms: (5Z)-1-benzyl-5-[5-(2,4-dimethoxyphenyl)pyrazolidin-3-ylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(c(c1)OC)C1NN/C(=C\2/C(=O)NC(=O)N(C2=O)Cc2ccccc2)/C1
STL008606
Synonyms: 5-(4-butoxyphenyl)-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Smiles: CCCCOc1ccc(cc1)C1CC(=O)Nc2c1c(=O)[nH]c(n2)c1ccccc1
STL008607
Synonyms: N,7-bis(2-methoxyphenyl)-5-methyl-2-(methylsulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: CSc1nc2n(n1)C(C(=C(N2)C)C(=O)Nc1ccccc1OC)c1ccccc1OC
STL008608
Synonyms: 5-(quinolin-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1c1cccc(c1)C(F)(F)F)c1ccc2c(n1)cccc2
STL008609
Synonyms: 2-phenyl-5-[4-(2-phenylethoxy)phenyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Smiles: O=C1Nc2nc([nH]c(=O)c2C(C1)c1ccc(cc1)OCCc1ccccc1)c1ccccc1
STL008610
Synonyms: N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]glycyl-L-alanine
Smiles: O=C(N[C@H](C(=O)O)C)CNC(=O)N1CC(=O)Nc2c1cccc2
STL008611
Synonyms: 1-(2-chlorophenyl)-6-(furan-2-ylmethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1[nH]c(=S)n(c2c1CN(CN2)Cc1ccco1)c1ccccc1Cl
STL008612
Synonyms: 4-[(2E)-3-(furan-2-yl)prop-2-enoyl]-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-5-(pyridin-4-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccncc1)CCCN1CCOCC1)/C=C/c1ccco1
STL008615
Synonyms: 8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C
STL008616
Synonyms: N-[(2Z)-3-(5-chloro-2-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-cyanoacetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1cc(Cl)ccc1OC)CS(=O)(=O)C2
STL008617
Synonyms: 7'-{(E)-[1-(2,4-dimethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O
STL008618
Synonyms: (1'R,2'R)-2'-(2-ethoxyphenyl)-1'-[(3-methoxyphenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: CCOc1ccccc1[C@H]1[C@H](C(=O)c2cccc(c2)OC)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C
STL008619
Synonyms: (5Z)-1-benzyl-5-{[1-(4-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Oc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)NC(=O)N(C1=O)Cc1ccccc1
STL008620
Synonyms: 1'-[2-(3,4-dimethoxyphenyl)ethyl]-13-methyl-1,2,3,4,5,5a-hexahydro-2'H,7H,8H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2-a]azepine-6,5'-pyrimidine]-2',4',6',8(1'H,3'H)-tetrone
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(=O)C2(C1=O)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C
STL008621
Synonyms: 3-methyl-8-(4-phenylpiperazin-1-yl)-7-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2CCCSc1nnnn1c1ccccc1)N1CCN(CC1)c1ccccc1
STL008622
Synonyms: 4-(2,4-dimethylphenyl)-1-(2-methylphenyl)-3-phenylpiperazine-2,5-dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)CN(C(=O)C1c1ccccc1)c1ccccc1C
STL008623
Synonyms: 1'-(2-chlorobenzyl)-13-methyl-1,2,3,4,5,5a-hexahydro-2'H,7H,8H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2-a]azepine-6,5'-pyrimidine]-2',4',6',8(1'H,3'H)-tetrone
Smiles: O=C1NC(=O)C2(C(=O)N1Cc1ccccc1Cl)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C
STL008625
Synonyms: 4-[4-(5-chloro-2-methoxybenzyl)piperazin-1-yl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide
Smiles: COc1ccc(cc1CN1CCN(CC1)C(=O)CCC(=O)Nc1nnc(s1)C1CCCCC1)Cl
STL008626
Synonyms: 2-cyano-N-[(2Z)-3-(2,4-difluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1F)F)CS(=O)(=O)C2
STL008628
Synonyms: 8-[4-(4-fluorobenzyl)piperazin-1-yl]-3-methyl-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)CN1CCN(CC1)c1nc2c(n1CC(C)C)c(=O)[nH]c(=O)n2C
STL008629
Synonyms: (1'R,2'R)-1'-(2,2-dimethylpropanoyl)-7'-methyl-2'-(2,3,4-trimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1OC)OC)[C@H]1[C@@H](N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C)C(=O)C(C)(C)C
STL008630
Synonyms: 7-(2,6-dichlorobenzyl)-8-(4-ethylpiperazin-1-yl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1Cc1c(Cl)cccc1Cl)c(=O)[nH]c(=O)n2C
STL008632
Synonyms: ethyl8-nitro-2',4',6'-trioxo-1'-(2-phenylethyl)-1,1',2,3',4,4',4a,6'-octahydro-2'H,3H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)CCc1ccccc1
STL008633
Synonyms: (1'R,2'R)-2'-(2,5-dimethoxyphenyl)-1'-[(3-methoxyphenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1cc(OC)ccc1OC)C(=O)c1c(C2=O)cccc1)C
STL008634
Synonyms: 3,4-dimethoxy-N-[6-(pyrrolidin-1-ylsulfonyl)-1,3-benzothiazol-2-yl]benzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)N1CCCC1
STL008635
Synonyms: (1'R,2'R)-2'-(3-chlorophenyl)-1'-[(4-chlorophenyl)carbonyl]-7'-fluoro-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1cccc(c1)[C@H]1[C@H](C(=O)c2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)F
STL008636
Synonyms: N-(4-methoxyphenyl)-5-methyl-2-(methylsulfanyl)-7-(pyridin-3-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1ccc(cc1)NC(=O)C1=C(C)Nc2n(C1c1cccnc1)nc(n2)SC
STL008637
Synonyms: 8-[benzyl(methyl)amino]-3-methyl-7-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2CCCSc1nnnn1c1ccccc1)N(Cc1ccccc1)C
STL008638
Synonyms: 4-(2,4-dimethylphenyl)-1-(2-fluorophenyl)-3-[4-(propan-2-yl)phenyl]piperazine-2,5-dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)CN(C(=O)C1c1ccc(cc1)C(C)C)c1ccccc1F
STL008639
Synonyms: 1-[2-(dimethylamino)ethyl]-5-(4-ethoxyphenyl)-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)C1C(=C(C(=O)N1CCN(C)C)O)C(=O)c1ccc(c(c1)F)OC(C)C
STL008640
Synonyms: 5-{2-[3-methyl-7-(2-methylpropyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazinylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CC(Cn1c(NN=C2C(=O)NC(=O)NC2=O)nc2c1c(=O)[nH]c(=O)n2C)C
STL008642
Synonyms: (5Z)-1-(2-methylphenyl)-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\c1cc2CCCN3c2c(c1)CCC3)c1ccccc1C
STL008643
Synonyms: 8-{[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-3-phenyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1NC(=O)C2(C(=O)N1)Cc1cc(NC=C3C(=O)N(C)C(=O)N(C3=O)C)ccc1N1C2CN(CC1)c1ccccc1
STL008644
Synonyms: 5-(2-{7-[2-hydroxy-3-(3-methylphenoxy)propyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}hydrazinylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1cccc(c1)OCC(Cn1c(NN=C2C(=O)NC(=O)NC2=O)nc2c1c(=O)n(C)c(=O)n2C)O
STL008645
Synonyms: (5E)-1-(5-chloro-2-methylphenyl)-5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\Nc2c(=O)n(n(c2C)C)c2ccccc2)/C1=O)C
STL008646
Synonyms: 1'-cyclohexyl-12-methyl-15,16-dihydro-2'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: O=C1NC(=O)C2(C(=O)N1C1CCCCC1)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C
STL008648
Synonyms: 3-chloro-N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-N-(2-methylpropyl)benzamide
Smiles: CC(CN(C(=O)c1cccc(c1)Cl)Cc1cc2cccc(c2nc1O)C)C
STL008649
Synonyms: 3-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-[4-(propan-2-yl)phenyl]propanamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CCn1c(=O)[nH]c2c(c1=O)cccc2
STL008650
Synonyms: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-(3-hydroxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Oc1cccc(c1)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
STL008651
Synonyms: (1'R,2'R)-2'-(2,4-dimethoxyphenyl)-1'-{[4-(2-methylpropyl)phenyl]carbonyl}-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1)OC)[C@H]1[C@H](C(=O)c2ccc(cc2)CC(C)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL008652
Synonyms: 5-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-4-{[3-fluoro-4-(propan-2-yloxy)phenyl]carbonyl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CN(CCCN1C(c2ccc(cc2)Cl)C(=C(C1=O)O)C(=O)c1ccc(c(c1)F)OC(C)C)C
STL008653
Synonyms: 5-hydroxy-N-[(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]tryptophan
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C)NC(C(=O)O)Cc1c[nH]c2c1cc(O)cc2
STL008654
Synonyms: 1,3-dimethyl-7'-({(Z)-[1-(2-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)c1ccccc1C
STL008655
Synonyms: N-(furan-2-ylmethyl)-N-[(2-hydroxyquinolin-3-yl)methyl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2ccccc2nc1O)Cc1ccco1
STL008656
Synonyms: 6-ethyl-3-(2-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Smiles: CCc1c(C)[nH]c2n(c1=O)nc(c2c1ccccc1OC)C
STL008657
Synonyms: 7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-8-[(2Z)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(N/N=C/2\C(=O)Nc3c2cccc3)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)C
STL008658
Synonyms: 1'-[2-(3,4-dimethoxyphenyl)ethyl]-12-methyl-15,16-dihydro-2'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(=O)C2(C1=O)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C
STL008659
Synonyms: 5-(2-{7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}hydrazinylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: OC(Cn1c(NN=C2C(=O)NC(=O)NC2=O)nc2c1c(=O)[nH]c(=O)n2C)COc1cccc(c1)C
STL008660
Synonyms: 5-[2-(3-methyl-2,6-dioxo-7-propyl-2,3,6,7-tetrahydro-1H-purin-8-yl)hydrazinylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCCn1c(NN=C2C(=O)NC(=O)NC2=O)nc2c1c(=O)[nH]c(=O)n2C
STL008661
Synonyms: N-[(2Z)-3-(2-chlorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-cyanoacetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1Cc1ccccc1Cl)CS(=O)(=O)C2
STL008662
Synonyms: 3-methyl-7-{2-methyl-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCOCC1)CSc1nnnn1c1ccccc1
STL008663
Synonyms: (3R)-2,2-dimethyl-5-oxo-N-{(1S)-2-oxo-1-phenyl-2-[(pyridin-4-ylmethyl)amino]ethyl}-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@H](c1ccccc1)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)NCc1ccncc1
STL008664
Synonyms: 2-(6,6-dimethyl-2,4-dioxo-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)-N-(3-methylbutyl)acetamide
Smiles: CC(CCNC(=O)Cn1c(=O)[nH]c2c(c1=O)c1CC(C)(C)OCc1s2)C
STL008666
Synonyms: 2-[2-(7-benzyl-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)ethyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CCc2nn3c(n2)c2c(nc3)n(c(c2C)C)Cc2ccccc2)C(=O)c2c1cccc2
STL008667
Synonyms: (2E)-N-benzyl-2-cyano-3-{[(2Z)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}prop-2-enamide
Smiles: N#C/C(=C\N=C\1/SC2C(N1c1ccccc1)CS(=O)(=O)C2)/C(=O)NCc1ccccc1
STL008668
Synonyms: methyl4-[(1E)-2-(1,3-benzoxazol-2-yl)-3-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-1-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C(/C(=O)c1ccc(c(c1)OC)OC)\c1nc2c(o1)cccc2
STL008669
Synonyms: 3-methoxy-N-[2,4,6-trioxo-1-(2-phenylethyl)-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide
Smiles: COc1cccc(c1)C(=O)NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2CCc1ccccc1)C(F)(F)F
STL008670
Synonyms: N-{2-oxo-2-[(pyridin-4-ylmethyl)amino]ethyl}-1-(phenylsulfonyl)piperidine-4-carboxamide
Smiles: O=C(NCc1ccncc1)CNC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1
STL008671
Synonyms: ethyl3-[4-methyl-9-(2-methylpropyl)-2-oxo-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-3-yl]propanoate
Smiles: CCOC(=O)CCc1c(=O)oc2c(c1C)ccc1c2CN(CO1)CC(C)C
STL008673
Synonyms: 1-{[(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]oxy}pyrrolidine-2,5-dione
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)ON1C(=O)CCC1=O
STL008674
Synonyms: trans-4-({[(4-fluorophenyl)sulfonyl]amino}methyl)-N-{2-[(2-methylpropyl)amino]-2-oxoethyl}cyclohexanecarboxamide
Smiles: CC(CNC(=O)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)F)C
STL008675
Synonyms: 3-methyl-8-[4-(3-methylbenzyl)piperazin-1-yl]-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1cccc(c1)C)C
STL008676
Synonyms: 1-cyclopropyl-6,7-difluoro-8-methoxy-4-oxo-N-(pyridin-4-ylmethyl)-1,4-dihydroquinoline-3-carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)NCc1ccncc1)C1CC1
STL008677
Synonyms: tert-butyl(2-{[(5E)-1,2,3,4,10,11-hexahydro-5H-spiro[benzo[c]pyrano[3,2-g]chromene-9,1'-cyclohexan]-5-ylideneamino]oxy}-2-oxo-1-phenylethyl)carbamate
Smiles: O=C(OC(C)(C)C)NC(c1ccccc1)C(=O)O/N=c\1/oc2cc3OC4(CCCCC4)CCc3cc2c2c1CCCC2
STL008678
Synonyms: (3E)-3-(1,3-benzodioxol-5-ylmethylidene)-2-(propan-2-yl)-2,3-dihydro-4H-1,2-benzothiazin-4-one1,1-dioxide
Smiles: CC(N1/C(=C/c2ccc3c(c2)OCO3)/C(=O)c2c(S1(=O)=O)cccc2)C
STL008679
Synonyms: 2-({[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]methyl}sulfanyl)-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)CSCc1nnnn1c1ccc(cc1C)C
STL008680
Synonyms: 6,7-dimethoxy-N-{3-[(2-methoxybenzyl)amino]-3-oxopropyl}-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)NCCC(=O)NCc1ccccc1OC
STL008681
Synonyms: 3-(4-chlorophenyl)-7,9-dimethyl-1-(2-oxopropyl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: Clc1ccc(cc1)C1=NN(CC(=O)C)c2n(C1)c1c(=O)n(C)c(=O)n(c1n2)C
STL008682
Synonyms: {2-[(1,3-benzodioxol-5-ylcarbonyl)oxy]phenyl}phosphonicacid
Smiles: O=C(c1ccc2c(c1)OCO2)Oc1ccccc1P(=O)(O)O
STL008683
Synonyms: N-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-2-oxoethyl]-2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetamide
Smiles: O=C(Cc1n[nH]c(=O)c2c1cccc2)NCC(=O)N1CCC2(CC1)OCCO2
STL008684
Synonyms: (5Z)-1-benzyl-5-({[2-(1-benzylpiperidin-4-yl)ethyl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: O=C1NC(=S)N(C(=O)/C/1=C\NCCC1CCN(CC1)Cc1ccccc1)Cc1ccccc1
STL008685
Synonyms: 4-{2-[(3-fluorobenzyl)oxy]-3-methoxyphenyl}-1-(4-fluorophenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: COc1cccc(c1OCc1cccc(c1)F)C1CC(=O)Nc2c1c(C)nn2c1ccc(cc1)F
STL008686
Synonyms: 2-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole
Smiles: Cc1csc(n1)N1N=C(CC1c1ccccc1)c1ccccc1
STL008688
Synonyms: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)S(=O)(=O)c1cccc2c1nsn2)NCc1cccs1
STL008689
Synonyms: 7-(1,3-benzodioxol-5-yl)-3-cyano-5-methyl-N-(2-methylphenyl)-4,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: N#Cc1cnn2c1NC(=C(C2c1ccc2c(c1)OCO2)C(=O)Nc1ccccc1C)C
STL008690
Synonyms: N-(1,3-benzodioxol-5-yl)-3-[(4S)-1-(1,3-benzodioxol-5-ylmethyl)-2,5-dioxoimidazolidin-4-yl]propanamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CC[C@@H]1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2
STL008691
Synonyms: furan-2-yl[3-(furan-2-yl)-5-(2-hydroxy-3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Smiles: COc1cccc(c1O)C1CC(=NN1C(=O)c1ccco1)c1ccco1
STL008692
Synonyms: 6-tert-butyl-2-[(3,4-dichlorobenzyl)sulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile
Smiles: N#Cc1c(SCc2ccc(c(c2)Cl)Cl)nc(cc1C(F)(F)F)C(C)(C)C
STL008693
Synonyms: 3-[(4S)-1-(1,3-benzodioxol-5-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-(9-ethyl-9H-carbazol-3-yl)propanamide
Smiles: CCn1c2ccc(cc2c2c1cccc2)NC(=O)CC[C@@H]1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2
STL008695
Synonyms: 8-[3-(dimethylamino)propyl]-3-(2-fluorobenzyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CN(CCCn1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)Cc1ccccc1F)C
STL008696
Synonyms: (3Z)-3-(4-hydroxy-3,5-dimethoxybenzylidene)-2-methyl-2,3-dihydro-4H-1,2-benzothiazin-4-one1,1-dioxide
Smiles: COc1cc(/C=C\2/C(=O)c3ccccc3S(=O)(=O)N2C)cc(c1O)OC
STL008697
Synonyms: N-[2-oxo-2-(quinolin-5-ylamino)ethyl]-1-(phenylsulfonyl)piperidine-4-carboxamide
Smiles: O=C(Nc1cccc2c1cccn2)CNC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1
STL008699
Synonyms: 6-(3,4-dimethoxyphenyl)-2-(methylsulfanyl)-4-(trifluoromethyl)pyridine-3-carbonitrile
Smiles: COc1ccc(cc1OC)c1nc(SC)c(c(c1)C(F)(F)F)C#N
STL008700
Synonyms: (2-{2-[(2-chlorobenzyl)amino]-2-oxoethoxy}phenyl)phosphonicacid
Smiles: O=C(COc1ccccc1P(=O)(O)O)NCc1ccccc1Cl
STL008701
Synonyms: 2,3,5,9-tetramethyl-6-[2-oxo-2-(3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl)ethyl]-7H-furo[3,2-g]chromen-7-one
Smiles: O=C(N1CCc2c(C1)[nH]cn2)Cc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C
STL008702
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(2-chlorophenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1CC(c2ccc3c(c2)OCO3)c2c(N1)n(nc2C)c1ccccc1Cl
STL008703
Synonyms: [1,7-dimethyl-3-(2-methylpropyl)-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]aceticacid
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)CC(=O)O)C)C
STL008704
Synonyms: 2-[(6-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide
Smiles: O=C(C(Oc1ccc2c(c1C)oc(=O)c1c2CCC1)C)NC1CC(C)(C)NC(C1)(C)C
STL008705
Synonyms: 3'-(1,3-benzodioxol-5-ylcarbonyl)-4'-(4-fluorophenyl)-5-methoxy-1'-methylspiro[indole-3,2'-pyrrolidin]-2(1H)-one
Smiles: COc1ccc2c(c1)C1(N(C)CC(C1C(=O)c1ccc3c(c1)OCO3)c1ccc(cc1)F)C(=O)N2
STL008707
Synonyms: 8-(2-hydroxyethyl)-1,7-dimethyl-3-(2-methylpropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CC(C)C
STL008708
Synonyms: 3-benzyl-1-[2-(6-formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1-methylthiourea
Smiles: O=Cc1c(CCN(C(=S)NCc2ccccc2)C)cc2c(c1OC)OCO2
STL008709
Synonyms: 2-{4,7-dimethyl-5-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
Smiles: CC(=C)COc1cc(C)cc2c1c(C)c(c(=O)o2)CC(=O)Nc1ccc(cc1)CN1CCOCC1
STL008710
Synonyms: 7-chloro-5-methyl-3-(4-methylphenyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
Smiles: Cc1ccc(cc1)c1c2nc(C)cc(n2nc1C(F)(F)F)Cl
STL008711
Synonyms: (1-ethyl-1H-imidazol-2-yl)(4-ethylphenyl)methanol
Smiles: CCc1ccc(cc1)C(c1nccn1CC)O
STL008712
Synonyms: ethyl(2-{[(5-methoxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]amino}-1,3-thiazol-4-yl)acetate
Smiles: CCOC(=O)Cc1csc(n1)NC(=O)Cc1c(=O)oc2c(c1C)c(OC)cc(c2)C
STL008713
Synonyms: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N~2~-[(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl]-L-alaninamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)[C@@H](NC(=O)Cc1n[nH]c(=O)c3c1cccc3)C)c[nH]2
STL008714
Synonyms: 2-methyl-N-[1-methyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]propanamide
Smiles: O=C(C(C)C)NC1(NC(=O)N(C1=O)C)C(F)(F)F
STL008715
Synonyms: (5E)-5-[(5-bromo-1H-indol-3-yl)methylidene]-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(=O)/C(=C\c2c[nH]c3c2cc(Br)cc3)/C1=O
STL008716
Synonyms: 2-[(2-methoxyphenoxy)methyl]-8,9-dimethyl-7-(pyridin-3-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1OCc1nc2n(n1)cnc1c2c(C)c(n1c1cccnc1)C
STL008718
Synonyms: methyl(6-chloro-4-methyl-2-oxo-9-propyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-3-yl)acetate
Smiles: CCCN1COc2c(C1)c1oc(=O)c(c(c1cc2Cl)C)CC(=O)OC
STL008719
Synonyms: N-[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methylbutanamide
Smiles: COc1ccc(cc1Cl)c1csc(n1)NC(=O)CC(C)C
STL008720
Synonyms: 5-amino-1-(3,4-dimethoxyphenyl)-N-methyl-1H-1,2,3-triazole-4-carboxamide
Smiles: CNC(=O)c1nnn(c1N)c1ccc(c(c1)OC)OC
STL008723
Synonyms: (3Z)-2-benzyl-3-(2-hydroxybenzylidene)-2,3-dihydro-4H-1,2-benzothiazin-4-one1,1-dioxide
Smiles: Oc1ccccc1/C=C\1/C(=O)c2ccccc2S(=O)(=O)N1Cc1ccccc1
STL008724
Synonyms: N-(2-methoxyphenyl)-5-methyl-2-(methylsulfanyl)-7-(thiophen-2-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1ccccc1NC(=O)C1=C(C)Nc2n(C1c1cccs1)nc(n2)SC
STL008725
Synonyms: 1-[(4-chlorophenyl)sulfonyl]-N-{2-[(3-fluorophenyl)amino]-2-oxoethyl}piperidine-3-carboxamide
Smiles: O=C(Nc1cccc(c1)F)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)Cl
STL008726
Synonyms: 6-methyl-2-{[(1-phenyl-1H-tetrazol-5-yl)methyl]sulfanyl}pyrimidin-4(3H)-one
Smiles: Cc1cc(=O)[nH]c(n1)SCc1nnnn1c1ccccc1
STL008727
Synonyms: 8-{3-[(4-chlorophenyl)amino]propyl}-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(cc1)NCCCn1c(C)cn2c1nc1c2c(=O)[nH]c(=O)n1C
STL008728
Synonyms: 3,5-dimethyl-6-[2-oxo-2-(3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl)ethyl]-7H-furo[3,2-g]chromen-7-one
Smiles: O=C(N1CCc2c(C1)[nH]cn2)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C
STL008729
Synonyms: 1-(4-chlorophenyl)-3-methyl-4-(thiophen-2-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1CC(c2cccs2)c2c(N1)n(nc2C)c1ccc(cc1)Cl
STL008730
Synonyms: methylN-{[4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidin-1-yl]carbonyl}-L-methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)N1CC/C(=C/2\c3ccc(cc3CCc3c2nccc3)Cl)/CC1
STL008731
Synonyms: 8-{2-[(2,5-dimethoxyphenyl)amino]ethyl}-1,3,6,7-tetramethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1NCCn1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)C)OC
STL008732
Synonyms: 1-cyclopropyl-6,7-difluoro-N-(2-hydroxy-2-phenylethyl)-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)NCC(c1ccccc1)O)C1CC1
STL008733
Synonyms: 2-({[1-(3,4-dichlorophenyl)-1H-tetrazol-5-yl]methyl}sulfanyl)-1-methyl-1H-benzimidazole
Smiles: Clc1ccc(cc1Cl)n1nnnc1CSc1nc2c(n1C)cccc2
STL008734
Synonyms: N-cyclohexyl-3-{(4S)-1-[2-(5-methoxy-1H-indol-3-yl)ethyl]-2,5-dioxoimidazolidin-4-yl}propanamide
Smiles: COc1ccc2c(c1)c(CCN1C(=O)N[C@H](C1=O)CCC(=O)NC1CCCCC1)c[nH]2
STL008735
Synonyms: 3-cyano-7-(4-hydroxyphenyl)-5-methyl-N-(2-methylphenyl)-4,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: N#Cc1cnn2c1NC(=C(C2c1ccc(cc1)O)C(=O)Nc1ccccc1C)C
STL008736
Synonyms: 2-[1-(naphthalen-2-ylsulfonyl)pyrrolidin-2-yl]-1H-benzimidazole
Smiles: O=S(=O)(N1CCCC1c1nc2c([nH]1)cccc2)c1ccc2c(c1)cccc2
STL008737
Synonyms: 2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]acetamide
Smiles: OC[C@@H](Cc1ccccc1)NC(=O)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1
STL008741
Synonyms: methyl[7-hydroxy-4-methyl-2-oxo-8-({[4-(trifluoromethoxy)phenyl]amino}methyl)-2H-chromen-3-yl]acetate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2CNc1ccc(cc1)OC(F)(F)F)O
STL008742
Synonyms: 3-(2-chloro-6-fluorobenzyl)-8-[2-(dimethylamino)ethyl]-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CN(CCn1c(C)c(n2c1nc1c2c(=O)n(c(=O)n1C)Cc1c(F)cccc1Cl)C)C
STL008743
Synonyms: Nalpha-({1-[(4-methoxyphenyl)sulfonyl]piperidin-3-yl}carbonyl)-N-propan-2-yl-L-phenylalaninamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)N[C@H](C(=O)NC(C)C)Cc1ccccc1
STL008744
Synonyms: N-(diphenylmethyl)-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)NC(c1ccccc1)c1ccccc1
STL008747
Synonyms: 2-{3-[4-(4-methylquinolin-2-yl)piperazin-1-yl]-3-oxopropyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1CCN(CC1)c1cc(C)c2c(n1)cccc2)CCN1C(=O)c2c(C1=O)cccc2
STL008748
Synonyms: 2-(4-chlorophenyl)-N-[(2Z)-3-methyl-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=C/1\SC2C(N1C)CS(=O)(=O)C2)Cc1ccc(cc1)Cl
STL008749
Synonyms: 1-(morpholin-4-yl)-4-[1-(morpholin-4-ylmethyl)-1H-indol-3-yl]butan-1-one
Smiles: O=C(N1CCOCC1)CCCc1cn(c2c1cccc2)CN1CCOCC1
STL008750
Synonyms: 2-{[3-(2-methoxyphenoxy)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}-N-(pyridin-3-ylmethyl)acetamide
Smiles: COc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)NCc1cccnc1
STL008751
Synonyms: 4-(quinolin-5-yl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(cc(c1OC)OC)c1nnc(n1c1cccc2c1cccn2)S
STL008752
Synonyms: N-{(2S)-1-[(2-methylphenyl)amino]-1-oxo-3-phenylpropan-2-yl}-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Smiles: O=C1Nc2ccccc2N(C1)C(=O)N[C@H](C(=O)Nc1ccccc1C)Cc1ccccc1
STL008753
Synonyms: methyl3-[(1-benzofuran-2-ylcarbonyl)amino]-4-methoxy-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1cc3c(o1)cccc3)c(OC)ccc2
STL008754
Synonyms: N-{3-[1-acetyl-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}acetamide
Smiles: CC(=O)Nc1cccc(c1)C1=NN(C(C1)c1ccco1)C(=O)C
STL008755
Synonyms: 5-amino-1-(2-ethoxyphenyl)-N-(2-methoxybenzyl)-1H-1,2,3-triazole-4-carboxamide
Smiles: CCOc1ccccc1n1nnc(c1N)C(=O)NCc1ccccc1OC
STL008756
Synonyms: methyl4-[7-(4-methoxyphenyl)-3-methyl-5-oxo-4,5,6,7,8,9-hexahydro[1,2]oxazolo[5,4-b]quinolin-4-yl]benzoate
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1c(C2c2ccc(cc2)C(=O)OC)c(no1)C
STL008757
Synonyms: 3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-7-hydroxy-4,8-dimethyl-2H-chromen-2-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)O
STL008758
Synonyms: N-[(2S)-1-[(4-ethoxyphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1ccc(cc1)OCC)NC(=O)N1CC(=O)Nc2c1cccc2
STL008759
Synonyms: 1-(3-bromophenyl)-N-[2-(3-fluorophenyl)ethyl]-9H-beta-carboline-3-carboxamide
Smiles: Fc1cccc(c1)CCNC(=O)c1nc(c2cccc(c2)Br)c2c(c1)c1ccccc1[nH]2
STL008760
Synonyms: 9-(2-methoxyethyl)-4-(4-methoxyphenyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: COCCN1COc2c(C1)c1oc(=O)cc(c1cc2)c1ccc(cc1)OC
STL008761
Synonyms: N-{2-[1-acetyl-5-(2-hydroxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
Smiles: CC(=O)N1N=C(CC1c1ccccc1O)c1ccccc1NS(=O)(=O)C
STL008762
Synonyms: N-[4-(3-ethyl-2,6-dioxopiperidin-3-yl)phenyl]-1-benzofuran-2-carboxamide
Smiles: CCC1(CCC(=O)NC1=O)c1ccc(cc1)NC(=O)c1cc2c(o1)cccc2
STL008763
Synonyms: 6-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dimethyl-7H-furo[3,2-g]chromen-7-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C
STL008764
Synonyms: 1-(3,4-dimethoxybenzyl)tetrahydro-1H-thieno[3,4-d]imidazole-2(3H)-thione5,5-dioxide
Smiles: COc1cc(ccc1OC)CN1C(=S)NC2C1CS(=O)(=O)C2
STL008765
Synonyms: 2-{4,7-dimethyl-5-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]acetamide
Smiles: COc1ccc2c(c1)[nH]cc2CCNC(=O)Cc1c(=O)oc2c(c1C)c(OCC(=C)C)cc(c2)C
STL008766
Synonyms: N-(2,5-dichlorophenyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]prolinamide
Smiles: Clc1ccc(c(c1)NC(=O)C1CCCN1S(=O)(=O)c1c(C)noc1C)Cl
STL008767
Synonyms: (4-{[(6-benzyl-5-hydroxy-1,2,4-triazin-3-yl)sulfanyl]methyl}phenyl)(phenyl)methanone
Smiles: O=C(c1ccccc1)c1ccc(cc1)CSc1nnc(c(n1)O)Cc1ccccc1
STL008768
Synonyms: 4-(1,3-benzodioxol-5-yl)-3-methyl-1-(2-methylphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1CC(c2ccc3c(c2)OCO3)c2c(N1)n(nc2C)c1ccccc1C
STL008771
Synonyms: 1-[(4-chlorophenyl)sulfonyl]-N-(5-methyl-1,3-thiazol-2-yl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)S(=O)(=O)c1ccc(cc1)Cl)Nc1ncc(s1)C
STL008772
Synonyms: 5-chloro-N-(3,5-dichlorophenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Smiles: CCSc1ncc(c(n1)C(=O)Nc1cc(Cl)cc(c1)Cl)Cl
STL008773
Synonyms: N-(3-methylbutyl)-1-(pyrimidin-2-yl)piperidine-4-carboxamide
Smiles: CC(CCNC(=O)C1CCN(CC1)c1ncccn1)C
STL008774
Synonyms: N-{2-[1-acetyl-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
Smiles: COc1ccc(cc1)C1CC(=NN1C(=O)C)c1ccccc1NS(=O)(=O)C
STL008775
Synonyms: 7-hydroxy-4-methyl-3-(2-oxo-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethyl)-2H-chromen-2-one
Smiles: Oc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N1CCN(CC1)C/C=C/c1ccccc1
STL008777
Synonyms: ethyl1-{[1-(pyrimidin-2-yl)piperidin-4-yl]carbonyl}piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)C(=O)C1CCN(CC1)c1ncccn1
STL008778
Synonyms: 4-(3-bromophenyl)-2-[5-(4-chlorophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazole
Smiles: Clc1ccc(cc1)C1CC(=NN1c1scc(n1)c1cccc(c1)Br)C
STL008779
Synonyms: methyl(7-hydroxy-4,8-dimethyl-2-oxo-6-{[(2-phenylethyl)amino]methyl}-2H-chromen-3-yl)acetate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2C)O)CNCCc1ccccc1
STL008780
Synonyms: 2-{4-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]-3-oxobutyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C(COc1ccc2c(c1)oc(=O)cc2C)CCN1C(=O)c2c(C1=O)cccc2
STL008781
Synonyms: 5-(6-amino-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-6-(3,4-dimethylphenyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Smiles: O=c1[nH]c2[nH]c(c(c2c(=O)[nH]1)c1c(N)[nH]c(=O)[nH]c1=O)c1ccc(c(c1)C)C
STL008782
Synonyms: N-{3-[(3-chlorobenzyl)amino]-3-oxopropyl}-1-[(4-methoxyphenyl)sulfonyl]piperidine-3-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)NCCC(=O)NCc1cccc(c1)Cl
STL008783
Synonyms: 5-ethyl-N-[(2S)-1-{[2-(2-hydroxyethoxy)ethyl]amino}-1-oxo-3-phenylpropan-2-yl]-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: OCCOCCNC(=O)[C@@H](NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)Cc1ccccc1
STL008784
Synonyms: N-methyl-4-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine
Smiles: CNc1nc(nc(n1)N1CCCC1)n1cnc(n1)SCCOc1ccccc1
STL008785
Synonyms: (3E)-3-(4-hydroxy-3,5-dimethoxybenzylidene)-2-(propan-2-yl)-2,3-dihydro-4H-1,2-benzothiazin-4-one1,1-dioxide
Smiles: COc1cc(/C=C/2\C(=O)c3ccccc3S(=O)(=O)N2C(C)C)cc(c1O)OC
STL008786
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-methyl-2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)C)Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
STL008787
Synonyms: (5E)-5-{[(1,1-dioxido-2,3-dihydrothiophen-3-yl)amino]methylidene}-1-(4-methoxybenzyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1)CN1C(=O)NC(=O)/C(=C\NC2C=CS(=O)(=O)C2)/C1=O
STL008790
Synonyms: (7-benzyl-3,9-dimethyl-6,8-dioxo-6,7,8,9-tetrahydro[1,2,4]triazino[3,4-f]purin-1(4H)-yl)aceticacid
Smiles: OC(=O)CN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1
STL008791
Synonyms: (2E)-2-[(4-methoxyphenyl)sulfonyl]-3-[(4-phenoxyphenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)Oc1ccccc1)/S(=O)(=O)c1ccc(cc1)OC
STL008792
Synonyms: 3-{(4S)-1-[2-(4-methoxyphenyl)ethyl]-2,5-dioxoimidazolidin-4-yl}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
Smiles: COc1ccc(cc1)CCN1C(=O)N[C@H](C1=O)CCC(=O)NC1CCCc2c1cccc2
STL008793
Synonyms: 4-methyl-2-oxo-3-{2-oxo-2-[(2-phenylethyl)amino]ethyl}-2H-chromene-5,7-diyldiacetate
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(OC(=O)C)cc(c2)OC(=O)C)NCCc1ccccc1
STL008794
Synonyms: methyl(8-{[(1,1-dioxidotetrahydrothiophen-3-yl)amino]methyl}-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2CNC1CCS(=O)(=O)C1)O
STL008796
Synonyms: 9-chloro-6-[2-(1,3-dioxan-2-yl)ethyl]-6H-indolo[2,3-b]quinoxaline
Smiles: Clc1ccc2c(c1)c1nc3ccccc3nc1n2CCC1OCCCO1
STL008797
Synonyms: N-(3-fluorophenyl)-1-(1H-indol-3-ylacetyl)piperidine-3-carboxamide
Smiles: Fc1cccc(c1)NC(=O)C1CCCN(C1)C(=O)Cc1c[nH]c2c1cccc2
STL008798
Synonyms: 2-(5,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
Smiles: COc1cc(OC)cc2c1c(C)c(c(=O)o2)CC(=O)Nc1scc(n1)C
STL008799
Synonyms: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3-methoxybenzyl)piperidine-3-carboxamide
Smiles: COc1cccc(c1)CNC(=O)C1CCCN(C1)S(=O)(=O)c1cccc2c1nsn2
STL008800
Synonyms: 2-[(3-benzyl-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]-N-(3-methylpyridin-2-yl)acetamide
Smiles: O=C(Nc1ncccc1C)COc1cc2OC(C)(C)CCc2c2c1c(C)c(Cc1ccccc1)c(=O)o2
STL008801
Synonyms: methyl(2-{[(2,4-dichlorophenyl)carbonyl]amino}-4-phenyl-1,3-thiazol-5-yl)carbamate
Smiles: COC(=O)Nc1sc(nc1c1ccccc1)NC(=O)c1ccc(cc1Cl)Cl
STL008802
Synonyms: (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(5-methoxy-1H-indol-3-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc2c(c1)c(c[nH]2)/C=C/1\C(=O)NC(=O)N(C1=O)CCc1ccc(c(c1)OC)OC
STL008803
Synonyms: N-[2,5-dioxo-1-phenyl-4-(trifluoromethyl)imidazolidin-4-yl]-3,4-dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)NC1(NC(=O)N(C1=O)c1ccccc1)C(F)(F)F
STL008804
Synonyms: 1-(4,6-dimethylpyrimidin-2-yl)-4-(3-ethoxy-4-hydroxyphenyl)-3-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: CCOc1cc(ccc1O)C1CC(=O)Nc2c1c(nn2c1nc(C)cc(n1)C)c1ccccc1
STL008805
Synonyms: N-(2,4-difluorophenyl)-2-(3,4,9-trimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c1occ(c1c(c2)C)C)Nc1ccc(cc1F)F
STL008806
Synonyms: 8-(2-hydroxyphenyl)-1,6,7-trimethyl-3-(2-methylprop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)c1ccccc1O
STL008807
Synonyms: (5Z)-4-methyl-1-[2-(morpholin-4-yl)ethyl]-2,6-dioxo-5-{[(2-oxo-2H-chromen-6-yl)amino]methylidene}-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(C)/C(=C/Nc2ccc3c(c2)ccc(=O)o3)/C(=O)N(C1=O)CCN1CCOCC1
STL008808
Synonyms: 1,7-dimethyl-8-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: O=c1[nH]c(=O)n(c2c1n1cc(n(c1n2)CCN1CCCCC1)C)C
STL008809
Synonyms: (3Z)-6-chloro-3-[(1-methyl-1H-indol-3-yl)methylidene]-1-(morpholin-4-ylmethyl)-1,3-dihydro-2H-indol-2-one
Smiles: Clc1ccc2c(c1)N(CN1CCOCC1)C(=O)/C/2=C\c1cn(c2c1cccc2)C
STL008810
Synonyms: 1-{[4-(acetylamino)phenyl]sulfonyl}-N-(2-hydroxy-2-phenylethyl)piperidine-3-carboxamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)NCC(c1ccccc1)O
STL008811
Synonyms: 2-[(1-methylpiperidin-4-yl)amino]-7H-naphtho[1,2,3-de]quinolin-7-one
Smiles: CN1CCC(CC1)Nc1nc2cccc3c2c(c1)c1ccccc1C3=O
STL008812
Synonyms: (5Z)-1-(4-methoxybenzyl)-5-{[(5-methyl-1,2-oxazol-3-yl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1)CN1C(=O)NC(=O)/C(=C/Nc2noc(c2)C)/C1=O
STL008813
Synonyms: N-[4-(2-hydroxyethyl)phenyl]-2-(5-methoxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: OCCc1ccc(cc1)NC(=O)Cc1c(=O)oc2c(c1C)c(OC)cc(c2)C
STL008814
Synonyms: 5-bromo-N-(2-oxo-2H-chromen-6-yl)-1-benzofuran-2-carboxamide
Smiles: Brc1ccc2c(c1)cc(o2)C(=O)Nc1ccc2c(c1)ccc(=O)o2
STL008815
Synonyms: 2-[3-(4-chlorobenzyl)-2,4-dioxo-1,3,8-triazaspiro[4.5]dec-8-yl]-N-(3,4-dimethoxyphenyl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CN1CCC2(CC1)NC(=O)N(C2=O)Cc1ccc(cc1)Cl
STL008816
Synonyms: N-[1-methyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]benzamide
Smiles: CN1C(=O)NC(C1=O)(NC(=O)c1ccccc1)C(F)(F)F
STL008817
Synonyms: 2-methoxy-N-[5-oxo-2-phenyl-1-(prop-2-en-1-yl)-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]benzamide
Smiles: C=CCN1C(=NC(C1=O)(NC(=O)c1ccccc1OC)C(F)(F)F)c1ccccc1
STL008819
Synonyms: 6-(3-methylphenyl)-3-(pyrazin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Cc1cccc(c1)c1nn2c(s1)nnc2c1cnccn1
STL008821
Synonyms: 3,9-dimethyl-7-[(2E)-3-phenylprop-2-en-1-yl]-1-(propan-2-yl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC1=NN(C(C)C)c2n(C1)c1c(=O)n(C/C=C/c3ccccc3)c(=O)n(c1n2)C
STL008823
Synonyms: 6-chloro-4-methyl-9-propyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: CCCN1COc2c(C1)c1oc(=O)cc(c1cc2Cl)C
STL008825
Synonyms: 1,7-dimethyl-3-(2-methylprop-2-en-1-yl)-8-[3-(morpholin-4-yl)propyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)CCCN1CCOCC1)C
STL008827
Synonyms: N-[3-(dimethylamino)propyl]-3-(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanamide
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)NCCCN(C)C
STL008828
Synonyms: 3-cyclohexyl-N-[1-(3-methoxyphenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]propanamide
Smiles: COc1cccc(c1)n1c(=O)[nH]c(=O)c2c1NC(=O)C2(NC(=O)CCC1CCCCC1)C(F)(F)F
STL008829
Synonyms: 3-{[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino}benzoicacid
Smiles: Cc1cc(Nc2cccc(c2)C(=O)O)c2c(n1)cc(cc2)C(F)(F)F
STL008830
Synonyms: N-[(2S)-1-[(furan-2-ylmethyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide
Smiles: CSCC[C@@H](C(=O)NCc1ccco1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1
STL008832
Synonyms: (2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-7-[(dibutylamino)methyl]-6-hydroxy-1-benzofuran-3(2H)-one
Smiles: CCCCN(Cc1c(O)ccc2c1O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O)CCCC
STL008834
Synonyms: N-{(2S)-1-[(4-chlorophenyl)amino]-1-oxopropan-2-yl}-1-[(4-methoxyphenyl)sulfonyl]piperidine-3-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)Cl)C
STL008835
Synonyms: 4-(2-{[(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]amino}ethyl)phenylacetate
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C)NCCc1ccc(cc1)OC(=O)C
STL008836
Synonyms: N-[1-(2-chlorobenzyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]cyclopropanecarboxamide
Smiles: O=C(C1CC1)NC1(NC(=O)N(C1=O)Cc1ccccc1Cl)C(F)(F)F
STL008837
Synonyms: 3-{3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-7-hydroxy-4,8-dimethyl-2H-chromen-2-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)CCc1c(=O)oc2c(c1C)ccc(c2C)O
STL008838
Synonyms: methyl3-{[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-6-methoxy-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC=C1C(=O)NC(=S)NC1=O)ccc(c2)OC
STL008840
Synonyms: N-(4-chloro-1,1-dioxidotetrahydrothiophen-3-yl)hexanamide
Smiles: CCCCCC(=O)NC1CS(=O)(=O)CC1Cl
STL008841
Synonyms: 8-[4-(2,5-dimethylbenzyl)piperazin-1-yl]-3-methyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1cc(C)ccc1C)C
STL008842
Synonyms: 2-(5,7-dihydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]acetamide
Smiles: COc1ccc2c(c1)[nH]cc2CCNC(=O)Cc1c(=O)oc2c(c1C)c(O)cc(c2)O
STL008843
Synonyms: N-{4-[(2-methoxy-5-methylphenyl)amino]-4-oxobutyl}-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Smiles: COc1ccc(cc1NC(=O)CCCNC(=O)N1CC(=O)Nc2c1cccc2)C
STL008844
Synonyms: N-(naphthalen-1-yl)-1-(pyrimidin-2-yl)piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)c1ncccn1)Nc1cccc2c1cccc2
STL008845
Synonyms: 3-{(4S)-1-[2-(5-chloro-1H-indol-3-yl)ethyl]-2,5-dioxoimidazolidin-4-yl}-N-cyclohexylpropanamide
Smiles: O=C(NC1CCCCC1)CC[C@@H]1NC(=O)N(C1=O)CCc1c[nH]c2c1cc(Cl)cc2
STL008846
Synonyms: N-{2-[(2-cyanoethyl)(methyl)amino]-2-oxoethyl}-1-[(4-fluorophenyl)sulfonyl]piperidine-4-carboxamide
Smiles: N#CCCN(C(=O)CNC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F)C
STL008847
Synonyms: N-[4-(naphthalen-1-ylamino)-4-oxobutyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Smiles: O=C(Nc1cccc2c1cccc2)CCCNC(=O)N1CC(=O)Nc2c1cccc2
STL008848
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-2-(8-benzyl-2,4-dioxo-1,3,8-triazaspiro[4.5]dec-3-yl)acetamide
Smiles: O=C(CN1C(=O)NC2(C1=O)CCN(CC2)Cc1ccccc1)NCc1ccc2c(c1)OCO2
STL008849
Synonyms: 3-{(4S)-1-[2-(1H-indol-3-yl)ethyl]-2,5-dioxoimidazolidin-4-yl}-N-(prop-2-en-1-yl)propanamide
Smiles: C=CCNC(=O)CC[C@@H]1NC(=O)N(C1=O)CCc1c[nH]c2c1cccc2
STL008850
Synonyms: N-[2-(3,4-dihydroxyphenyl)ethyl]-2-{(1E)-5-fluoro-2-methyl-1-[4-(methylsulfinyl)benzylidene]-1H-inden-3-yl}acetamide
Smiles: O=C(CC1=C(C)/C(=C\c2ccc(cc2)S(=O)C)/c2c1cc(F)cc2)NCCc1ccc(c(c1)O)O
STL008852
Synonyms: N-[1-(2-methoxyphenyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]cyclopropanecarboxamide
Smiles: COc1ccccc1N1C(=O)NC(C1=O)(NC(=O)C1CC1)C(F)(F)F
STL008853
Synonyms: 2-(1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl)acetohydrazide
Smiles: NNC(=O)Cn1c(C)cn2c1nc1c2c(=O)[nH]c(=O)n1C
STL008854
Synonyms: 6-{[(4-chloro-2,5-dimethoxyphenyl)amino]methyl}-7-hydroxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Smiles: COc1cc(Cl)c(cc1NCc1c(O)ccc2c1oc(=O)c1c2CCC1)OC
STL008855
Synonyms: 1-{[4-(acetylamino)phenyl]sulfonyl}-N-(quinolin-6-yl)piperidine-3-carboxamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)Nc1ccc2c(c1)cccn2
STL008856
Synonyms: N-(2,5-dimethoxyphenyl)-2-(5-oxo-2-phenyl-5,6-dihydro-4H-imidazo[1,2-b][1,2,4]triazol-6-yl)acetamide
Smiles: COc1ccc(c(c1)NC(=O)CC1C(=O)Nc2n1nc(n2)c1ccccc1)OC
STL008857
Synonyms: (2E)-2-(1,3-benzoxazol-2-yl)-3-[4-(benzyloxy)-3-ethoxyphenyl]-1-(3,4-dimethoxyphenyl)prop-2-en-1-one
Smiles: CCOc1cc(ccc1OCc1ccccc1)/C=C(/C(=O)c1ccc(c(c1)OC)OC)\c1nc2c(o1)cccc2
STL008858
Synonyms: 4-(3,4-dimethoxyphenyl)-2-(3-methyl-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl)-1,3-thiazole
Smiles: COc1cc(ccc1OC)c1csc(n1)N1N=C(CC1c1ccccc1)C