FULL DB

Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )

STL043434
Synonyms: N-[(E)-(1-methyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]tryptophan
Smiles: OC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=O)N=C(N(C1=O)C)S

STL043435
Synonyms: 8-{[2-(dimethylamino)ethyl]amino}-6-hydroxy-3-methyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-2H-purin-2-one
Smiles: CN(CCNc1nc2c(n1Cc1cccc3c1cccc3)c(O)nc(=O)n2C)C

STL043436
Synonyms: 6-(methoxycarbonyl)-2-{(1E)-1-[(4-methoxyphenyl)iminio]butyl}-5,5-dimethyl-3-oxocyclohex-1-en-1-olate
Smiles: CCC/C(=[NH+]\c1ccc(cc1)OC)/C1=C([O-])C(C(CC1=O)(C)C)C(=O)OC

STL043451
Synonyms: 5-methoxy-2-{[(1-methyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate
Smiles: COc1ccc(c(c1)[O-])CNc1[nH+]c2c(n1C)cccc2

STL043457
Synonyms: 7-(2-ethoxyethyl)-6-hydroxy-3-methyl-8-(methylsulfanyl)-3,7-dihydro-2H-purin-2-one
Smiles: CSc1nc2c(n1CCOCC)c(O)nc(=O)n2C

STL043467
Synonyms: methyl6-hydroxy-1,3-dimethyl-2,4-dioxo-N-phenyl-1,2,3,4-tetrahydropyrimidine-5-carbimidothioate
Smiles: CS/C(=N\c1ccccc1)/c1c(O)n(C)c(=O)n(c1=O)C

STL043469
Synonyms: (2-oxo-1,2-dihydroquinolin-3-yl)methylpyridine-3-carboxylate
Smiles: O=C(c1cccnc1)OCc1cc2ccccc2[nH]c1=O

STL043473
Synonyms: 2-(4-methoxyphenyl)-N-[(2Z)-5-methyl-4-oxo-1,3-thiazolidin-2-ylidene]acetamide
Smiles: COc1ccc(cc1)CC(=O)/N=C\1/NC(=O)C(S1)C

STL043483
Synonyms: (5Z)-3-(2-ethoxyphenyl)-6-hydroxy-5-[(piperidin-1-ylamino)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccccc1N1C(=O)N=C(/C(=C/NN2CCCCC2)/C1=O)O

STL043487
Synonyms: 4-{(3E)-2-(4-fluorophenyl)-3-[hydroxy(4-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}butanoicacid
Smiles: OC(=O)CCCN1C(c2ccc(cc2)F)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O

STL043492
Synonyms: (2Z)-2-(1H-benzimidazol-2-yl)-4-(3,4-dimethoxyphenyl)-3-hydroxybut-2-enenitrile
Smiles: COc1cc(ccc1OC)C/C(=C(/c1nc2c([nH]1)cccc2)\C#N)/O

STL043500
Synonyms: (5Z)-3-butyl-5-{[1-(3-chloropropyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCCCN1C(=O)N=C(/C(=C/c2ccc3c(c2)CCN3CCCCl)/C1=O)O

STL043505
Synonyms: 4-[5-(4-chlorophenyl)-2-(3-nitrophenyl)-4,6-dioxohexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenylbenzenesulfonate
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1ccc(cc1)OS(=O)(=O)c1ccccc1)c1cccc(c1)[N+](=O)[O-]

STL043514
Synonyms: 8-[4-(2-{[5-bromo-2-(methoxycarbonyl)-1H-indol-3-yl]amino}-2-oxoethyl)piperazin-4-ium-1-yl]-3-methyl-2-oxo-7-propyl-3,7-dihydro-2H-purin-6-olate
Smiles: CCCn1c(nc2c1c([O-])nc(=O)n2C)N1CC[NH+](CC1)CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STL043520
Synonyms: 3-fluoro-N-[(4Z)-2-(2-fluorophenyl)quinazolin-4(3H)-ylidene]aniline
Smiles: Fc1cccc(c1)/N=c/1\[nH]c(nc2c1cccc2)c1ccccc1F

STL043521
Synonyms: 6-chloro-4-ethyl-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-2-oxo-2H-chromen-7-olate
Smiles: CCc1cc(=O)oc2c1cc(Cl)c(c2C[NH+]1CCN(CC1)C)[O-]

STL043524
Synonyms: (1E,2E)-1-{1-[2-(diethylammonio)ethyl]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}-3-phenylprop-2-en-1-olate
Smiles: CC[NH+](CCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/C=C/c2ccccc2)\[O-])/C(=O)C1=O)CC

STL043528
Synonyms: 1-{3-(3,4-dimethoxyphenyl)-1-hydroxy-11-[4-(trifluoromethyl)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}hexan-1-one
Smiles: CCCCCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(c(c2)OC)OC)C1c1ccc(cc1)C(F)(F)F

STL043540
Synonyms: 4-(4-ethoxyphenyl)-7-hydroxy-1-(pentan-3-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: CCOc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C(CC)CC)O

STL043541
Synonyms: (4E)-4-[hydroxy(4-methylphenyl)methylidene]-5-[4-(propan-2-yl)phenyl]-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)C(C)C)N(C(=O)C1=O)c1scnn1)/O

STL043542
Synonyms: [11-(3-ethoxy-4-hydroxyphenyl)-1-hydroxy-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl](phenyl)methanone
Smiles: CCOc1cc(ccc1O)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)c1ccccc1)cccc2)(C)C

STL043555
Synonyms: (5E)-3-(4-fluorophenyl)-6-hydroxy-5-({1-[2-(2-methoxyphenoxy)ethyl]-1H-pyrrol-2-yl}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccccc1OCCn1cccc1/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)F)O

STL043575
Synonyms: 1-[(2Z)-5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-methoxyphenyl)urea
Smiles: COc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)COc1cccc(c1C)C

STL043580
Synonyms: (6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl2-fluorobenzoate
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)COC(=O)c1ccccc1F

STL043589
Synonyms: 3-{(1Z)-1-[2-([1,2,4]triazolo[4,3-b]pyridazin-5-ium-6-yl)hydrazinylidene]ethyl}phenolate
Smiles: [O-]c1cccc(c1)/C(=N\Nc1ccc2n([nH+]1)cnn2)/C

STL043592
Synonyms: N-(6-bromo-2-hydroxy-4-phenylquinolin-3-yl)benzenesulfonamide
Smiles: Brc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)NS(=O)(=O)c1ccccc1

STL043598
Synonyms: N-(4-ethoxyphenyl)-2-methoxy-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]acetamide
Smiles: COCC(=O)N(c1ccc(cc1)OCC)Cc1cc2ccc(cc2[nH]c1=O)C

STL043605
Synonyms: ethyl(2E)-2-cyano-3-(5,6,7,8-tetrahydro-2H-pyrazolo[3,4-b]quinolin-3-ylamino)prop-2-enoate
Smiles: CCOC(=O)/C(=C/Nc1[nH]nc2c1cc1CCCCc1n2)/C#N

STL043606
Synonyms: 2,4-dibromo-6-[(E)-{2-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-3-ium-2-yl)carbonyl]hydrazinylidene}methyl]phenolate
Smiles: Brc1cc(/C=N/NC(=O)c2[nH+]c3n(n2)c(C)cc(n3)C)c(c(c1)Br)[O-]

STL043625
Synonyms: 2-ethyl-5-hydroxy-4-[(1-methyl-1H-benzimidazol-3-ium-2-yl)acetyl]phenolate
Smiles: CCc1cc(c(cc1[O-])O)C(=O)Cc1[nH+]c2c(n1C)cccc2

STL043634
Synonyms: (2-oxo-1,2-dihydroquinolin-3-yl)methyl3-methoxybenzoate
Smiles: COc1cccc(c1)C(=O)OCc1cc2ccccc2[nH]c1=O

STL043643
Synonyms: (7E)-7-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)iminio]-4-nitrocyclohepta-1,3,5-trien-1-olate
Smiles: [O-][N+](=O)c1ccc(/c(=[NH+]/c2c(C)n(n(c2=O)c2ccccc2)C)/cc1)[O-]

STL043694
Synonyms: N-(2-{2-[(Z)-(4-hydroxy-2,6-dioxo-1-phenyl-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]-1H-indol-3-yl}ethyl)propanamide
Smiles: CCC(=O)NCCc1c(/C=C\2/C(=NC(=O)N(C2=O)c2ccccc2)O)[nH]c2c1cccc2

STL043699
Synonyms: (2Z)-2-[(6-chloro-4-phenylquinazolin-2-yl)imino]-2,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-4-ol
Smiles: Clc1ccc2c(c1)c(nc(n2)/N=c/1\nc(O)c2c([nH]1)CCC2)c1ccccc1

STL043708
Synonyms: 1-(2-{[(2E)-6-ethoxy-4-methylquinazolin-2(1H)-ylidene]amino}-4,6-dimethylpyrimidin-5-yl)ethanone
Smiles: CCOc1ccc2c(c1)c(C)n/c(=N/c1nc(C)c(c(n1)C)C(=O)C)/[nH]2

STL043709
Synonyms: {(3Z)-3-[(2Z)-4-hydroxy-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazol-5(2H)-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}aceticacid
Smiles: OC(=O)CN1c2ccccc2/C(=C\2/S/C(=N\c3cccc(c3)C(F)(F)F)/N=C2O)/C1=O

STL043713
Synonyms: 2,3-dihydro-1H-phenothiazin-4-ol
Smiles: OC1=C2Sc3ccccc3N=C2CCC1

STL043724
Synonyms: (E)-(4-methoxy-3-methylphenyl)[2-(2-methoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: COc1ccccc1C1/C(=C(/c2ccc(c(c2)C)OC)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL043725
Synonyms: 1-[4-(ethoxycarbonyl)phenyl]-5-[(S)-{1-[4-(ethoxycarbonyl)phenyl]-4,6-dihydroxy-2-oxo-1,2-dihydropyrimidin-5-yl}(pyridinium-4-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: CCOC(=O)c1ccc(cc1)n1c(=O)nc(c(c1O)[C@@H](c1c([O-])[nH]c(=O)n(c1=O)c1ccc(cc1)C(=O)OCC)c1cc[nH+]cc1)O

STL043732
Synonyms: 2-[(1-cyclohexyl-5-ethyl-6-hydroxy-4-oxo-1,4-dihydropyrimidin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide
Smiles: CCc1c(=O)nc(n(c1O)C1CCCCC1)SCC(=O)Nc1ccc(cc1)C

STL043733
Synonyms: 5-(4-bromophenyl)-7-(4-ethylphenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CCc1ccc(cc1)C1C=C(N=c2n1nc[nH]2)c1ccc(cc1)Br

STL043742
Synonyms: (5Z)-1-(2-fluorophenyl)-5-[(piperidin-1-ylamino)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\NN1CCCCC1)c1ccccc1F

STL043746
Synonyms: 4-(morpholin-4-yl)-9-sulfanyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-ol
Smiles: Sc1nc(O)c2c(n1)c1c(s2)nc(c2c1CCC2)N1CCOCC1

STL043748
Synonyms: 2-[(6-chloro-2-hydroxy-4-phenylquinolin-3-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STL043749
Synonyms: N-{(E)-amino[(2Z)-1,3-benzoxazol-2(3H)-ylideneamino]methylidene}-2-phenyl-2-(phenylsulfanyl)acetamide
Smiles: N/C(=N\C(=O)C(c1ccccc1)Sc1ccccc1)/N=c/1\oc2c([nH]1)cccc2

STL043750
Synonyms: 4-[(4-bromo-1H-pyrazol-2-ium-1-yl)methyl]benzoate
Smiles: [O-]C(=O)c1ccc(cc1)Cn1[nH+]cc(c1)Br

STL043760
Synonyms: N-methyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]pyridine-3-carboxamide
Smiles: O=C(N(Cc1cc2ccccc2[nH]c1=O)C)c1cccnc1

STL043771
Synonyms: 4-[(E)-{2-[(3-hydroxy-5-methyl-1H-pyrazol-4-yl)acetyl]hydrazinylidene}methyl]-2,6-dimethoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)Cc2c(C)[nH]nc2O)cc(c1OC(=O)C)OC

STL043778
Synonyms: N-[(4E)-1,7-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-ylidene]-3-methoxyaniline
Smiles: COc1cccc(c1)/N=c\1/nc[nH]c2c1cn[nH]2

STL043790
Synonyms: (5E)-5-({1-[2-(2-fluorophenoxy)ethyl]-1H-indol-3-yl}methylidene)-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2ccccc2F)/C(=N1)O

STL043805
Synonyms: N'-[(E)-(1-butyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]pentanehydrazide
Smiles: CCCCC(=O)NN/C=C/1\C(=O)N=C(N(C1=O)CCCC)S

STL043807
Synonyms: (2-oxo-1,2-dihydroquinolin-3-yl)methylfuran-2-carboxylate
Smiles: O=C(c1ccco1)OCc1cc2ccccc2[nH]c1=O

STL043814
Synonyms: (E)-[4,5-dioxo-1-(pyridinium-3-ylmethyl)-2-(pyridin-4-yl)pyrrolidin-3-ylidene](4-methoxy-3-methylphenyl)methanolate
Smiles: COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)Cc1ccc[nH+]c1)/[O-]

STL043822
Synonyms: 2-methoxy-N-methyl-5-{[(1Z)-4-methylphthalazin-1(2H)-ylidene]amino}benzamide
Smiles: CNC(=O)c1cc(ccc1OC)/N=c/1\[nH]nc(c2c1cccc2)C

STL043830
Synonyms: 4-{(E)-[(3-cyclohexyl-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)imino]methyl}-2,6-dimethoxyphenylacetate
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2C2CCCCC2)cc(c1OC(=O)C)OC

STL043833
Synonyms: 4-benzyl-5-(4-butoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCCCOc1ccc(cc1)c1n[nH]c(=S)n1Cc1ccccc1

STL043846
Synonyms: N-butyl-3,4-dimethoxy-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: CCCCN(C(=O)c1ccc(c(c1)OC)OC)Cc1cc2cc(C)ccc2[nH]c1=O

STL043855
Synonyms: N'-[(E)-(2,4-dihydroxy-6-methylpyrimidin-5-yl)methylidene]-4-propoxybenzohydrazide
Smiles: CCCOc1ccc(cc1)C(=O)N/N=C/c1c(C)nc(nc1O)O

STL043863
Synonyms: 4-hydroxy-2,6-diphenyl-3-(propan-2-yl)-4-propylpiperidinium
Smiles: CCCC1(O)CC([NH2+]C(C1C(C)C)c1ccccc1)c1ccccc1

STL043867
Synonyms: 2-{[3-cyano-5-hydroxy-4-(2-methylphenyl)-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)OC)N=C2C(=C(O)CCC2)C1c1ccccc1C

STL043878
Synonyms: N-[2-hydroxy-3-(2-hydroxy-4,4-dimethyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl)propyl]-N-(3-nitrophenyl)benzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccccc1)c1cccc(c1)[N+](=O)[O-])CN1C(=NC(C1=O)(C)C)O

STL043879
Synonyms: 5-[2-(morpholin-4-yl)ethyl]-N-[(2E)-4,6,7-trimethylquinazolin-2(1H)-ylidene]-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: Cc1cc2c(C)n/c(=N/C3=NCN(CN3)CCN3CCOCC3)/[nH]c2cc1C

STL043906
Synonyms: N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]benzamide
Smiles: S=C(Nc1cc(cc(c1O)Cl)[N+](=O)[O-])NC(=O)c1ccccc1

STL043907
Synonyms: {(3E)-3-[hydroxy(4-methylphenyl)methylidene]-4,5-dioxo-2-phenylpyrrolidin-1-yl}aceticacid
Smiles: OC(=O)CN1C(c2ccccc2)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O

STL043911
Synonyms: 4-{(1E)-N-[4-(4-chlorophenyl)piperazin-4-ium-1-yl]propanimidoyl}phenolate
Smiles: CC/C(=N\N1CC[NH+](CC1)c1ccc(cc1)Cl)/c1ccc(cc1)[O-]

STL043913
Synonyms: 1-(4-ethoxyphenyl)-3-[(2E)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: CCOc1ccc(cc1)NC(=O)/N=c/1\[nH]nc(s1)C

STL043917
Synonyms: 2-hydroxy-1-(3-methylbutyl)-4-oxo-N-(pyridin-3-yl)-1,4-dihydroquinoline-3-carboxamide
Smiles: CC(CCn1c(O)c(C(=O)Nc2cccnc2)c(=O)c2c1cccc2)C

STL043918
Synonyms: (4E)-5-(2-fluorophenyl)-1-(2-hydroxyethyl)-4-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]pyrrolidine-2,3-dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\C=C\c2ccccc2)/O)/C1c1ccccc1F

STL043919
Synonyms: 4-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(3,4-dimethoxyphenyl)-4,5-dioxopyrrolidin-1-yl]butanoicacid
Smiles: COc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CCCC(=O)O

STL043924
Synonyms: 4-fluoro-N-[(4E)-1-phenyl-1,7-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-ylidene]aniline
Smiles: Fc1ccc(cc1)/N=c\1/nc[nH]c2c1cnn2c1ccccc1

STL043927
Synonyms: 3-(1-methyl-1H-benzimidazol-2-yl)-8-(morpholin-4-ium-4-ylmethyl)-2-oxo-2H-chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCOCC1)oc(=O)c(c2)c1nc2c(n1C)cccc2

STL043933
Synonyms: (5Z)-6-hydroxy-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)-3-(4-methoxybenzyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)CN1C(=O)N=C(/C(=C/NCCCn2cncc2)/C1=O)O

STL043936
Synonyms: (4E)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-5-[3-methoxy-4-(pentyloxy)phenyl]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: CCCCCOc1ccc(cc1OC)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1c1noc(c1)C

STL043939
Synonyms: (5Z)-6-hydroxy-3-(4-methoxyphenyl)-5-({[3-(morpholin-4-yl)propyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C/NCCCN2CCOCC2)/C1=O)O

STL043945
Synonyms: 4-[5-(2-hydroxy-8-methylquinolin-3-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cc2cccc(c2nc1O)C)c1ccccc1

STL043946
Synonyms: (E)-{1-[3-(dimethylammonio)propyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Smiles: Fc1ccc(cc1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C

STL043952
Synonyms: (E)-[2-(2-fluorophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)Cc1ccc[nH+]c1)/[O-]

STL043964
Synonyms: N-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-7-hydroxy-5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-6-carboxamide
Smiles: CCc1n[nH]/c(=N\C(=O)c2c(O)c3cccc4c3n(c2=O)CCC4)/s1

STL043968
Synonyms: 5-fluoro-2-hydroxy-6'-methyl-2'-(methylsulfanyl)-4H-1,4'-bipyrimidin-4-one
Smiles: CSc1nc(C)cc(n1)n1cc(F)c(=O)nc1O

STL043969
Synonyms: N-(3-fluorobenzyl)-3-hydroxy-1-oxo-6,7-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-2-carboxamide
Smiles: Fc1cccc(c1)CNC(=O)c1c(=O)c2cccc3c2n(c1O)CCC3

STL043975
Synonyms: N-[2-(2-{(Z)-[1-(2-fluorophenyl)-2-hydroxy-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-3-yl)ethyl]acetamide
Smiles: CC(=O)NCCc1c(/C=C\2/C(=O)N=C(N(C2=O)c2ccccc2F)O)[nH]c2c1cccc2

STL043998
Synonyms: (4-{(E)-[1-(4-ethylphenyl)-2-hydroxy-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}phenoxy)aceticacid
Smiles: CCc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(cc2)OCC(=O)O)/C1=O)O

STL043999
Synonyms: (5Z)-3-benzyl-5-[(1-ethyl-2,3-dihydro-1H-indol-5-yl)methylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCN1CCc2c1ccc(c2)/C=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O

STL044002
Synonyms: 5-cyclopropyl-5-methyl-2-phenyl-2,5-dihydro-1H-1,2,4-triazole-3-thiol
Smiles: SC1=NC(NN1c1ccccc1)(C)C1CC1

STL044009
Synonyms: N-ethyl-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]furan-2-carboxamide
Smiles: CCN(C(=O)c1ccco1)Cc1cc2cc(OC)ccc2[nH]c1=O

STL044018
Synonyms: N,N'-benzene-1,3-diylbis[2-(4-hydroxy-2-oxo-2,5-dihydro-1,3-thiazol-5-yl)acetamide]
Smiles: O=C(Nc1cccc(c1)NC(=O)CC1SC(=O)N=C1O)CC1SC(=O)N=C1O

STL044020
Synonyms: 1-(4,6-dimethylpyrimidin-2-yl)-2-(6-methylpyridin-2-yl)guanidine
Smiles: Cc1cccc(n1)/N=C(/Nc1nc(C)cc(n1)C)\N

STL044023
Synonyms: (5Z)-5-({[4-(diethylamino)phenyl]amino}methylidene)-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CCN(c1ccc(cc1)N/C=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)CC

STL044032
Synonyms: 2-hydroxy-N'-{(E)-[1-(3-methoxyphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}benzohydrazide
Smiles: COc1cccc(c1)N1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2O)/C1=O)S

STL044044
Synonyms: 5-{2-[4-(propan-2-yloxy)phenyl]ethyl}-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: C=CCn1c(CCc2ccc(cc2)OC(C)C)n[nH]c1=S

STL044061
Synonyms: 4-hydroxy-2-oxo-N-[(2E)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: CCCc1n[nH]/c(=N\C(=O)c2c(=O)[nH]c3c(c2O)CCCC3)/s1

STL044065
Synonyms: 1-butyl-2-hydroxy-4-oxo-N-(pyrazin-2-yl)-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCn1c(O)c(C(=O)Nc2cnccn2)c(=O)c2c1cccc2

STL044068
Synonyms: (5Z)-5-(4-fluorobenzylidene)-6-hydroxy-3-(3-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1cccc(c1)N1C(=O)N=C(/C(=C/c2ccc(cc2)F)/C1=O)O

STL044099
Synonyms: 1-[N'-(4,6-dimethylpyrimidin-2-yl)-N-(phenylacetyl)carbamimidoyl]piperidine-4-carboxamide
Smiles: O=C(N/C(=N/c1nc(C)cc(n1)C)/N1CCC(CC1)C(=O)N)Cc1ccccc1

STL044118
Synonyms: N-(5,7-diphenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide
Smiles: CC(=O)Nc1nn2c(=NC(=CC2c2ccccc2)c2ccccc2)[nH]1

STL044119
Synonyms: 3-(6-sulfanyl-9H-purin-9-yl)propanenitrile
Smiles: N#CCCn1cnc2c1ncnc2S

STL044123
Synonyms: (5E)-1-(3-methylphenyl)-5-({[2-(piperidin-1-yl)ethyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cccc(c1)N1C(=NC(=O)/C(=C\NCCN2CCCCC2)/C1=O)S

STL044126
Synonyms: 6-methyl-2-phenyl-1,2,4-triazaspiro[4.5]dec-3-ene-3-thiol
Smiles: SC1=NC2(NN1c1ccccc1)CCCCC2C

STL044135
Synonyms: 4-{[(E)-(4-methoxyphenyl)methylidene]amino}-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1)/C=N/n1c(COc2ccccc2)n[nH]c1=S

STL044143
Synonyms: (5Z)-3-[2-(cyclohex-1-en-1-yl)ethyl]-6-hydroxy-5-{[(3-hydroxypropyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: OCCCN/C=C\1/C(=NC(=O)N(C1=O)CCC1=CCCCC1)O

STL044158
Synonyms: 7-(3-bromobenzyl)-8-{[2-(dimethylamino)ethyl]amino}-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CN(CCNc1nc2c(n1Cc1cccc(c1)Br)c(O)nc(=O)n2C)C

STL044162
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate
Smiles: Cc1ccc(cc1)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1sc(nc1C)C)/[O-]

STL044175
Synonyms: N-cyclohexyl-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]cyclohexanecarboxamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)C1CCCCC1)C1CCCCC1

STL044186
Synonyms: N'-[(E)-(1-ethyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]benzohydrazide
Smiles: CCN1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2)/C1=O)S

STL044188
Synonyms: 4-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]butanoicacid
Smiles: OC(=O)CCCN1C(c2ccc(cc2)C)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STL044217
Synonyms: 4-benzyl-5-[(2-methylphenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccccc1OCc1n[nH]c(=S)n1Cc1ccccc1

STL044229
Synonyms: N,N-diethyl-5-(4-hydroxyphthalazin-1-yl)-2-methylbenzenesulfonamide
Smiles: CCN(S(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)O)CC

STL044246
Synonyms: 2-[(1,5-dicyano-4-hydroxy-3-azaspiro[5.5]undeca-1,3-dien-2-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide
Smiles: N#CC1C(=NC(=C(C21CCCCC2)C#N)SCC(=O)Nc1ccc(cc1C)C)O

STL044249
Synonyms: 6-chloro-3-[(Z)-2-hydroxy-2-phenylethenyl]-2H-1,4-benzoxazin-2-one
Smiles: Clc1ccc2c(c1)nc(c(=O)o2)/C=C(/c1ccccc1)\O

STL044252
Synonyms: (E)-[2-(2-fluorophenyl)-4,5-dioxo-1-(pyridinium-3-yl)pyrrolidin-3-ylidene](phenyl)methanolate
Smiles: [O-]/C(=C/1\C(c2ccccc2F)N(C(=O)C1=O)c1ccc[nH+]c1)/c1ccccc1

STL044255
Synonyms: 2-methyl-5-[(2-methyl-1H-benzimidazol-6-yl)methyl]-1H-benzimidazole
Smiles: Cc1[nH]c2c(n1)cc(cc2)Cc1ccc2c(c1)[nH]c(n2)C

STL044258
Synonyms: 11-hydroxy-7,7-dimethyl-10-(pyridin-3-yl)-6,7,8,10-tetrahydro-9H-indeno[1,2-b]quinolin-9-one
Smiles: O=C1CC(C)(C)CC2=C1C(c1cccnc1)C1=C(O)c3c(C1=N2)cccc3

STL044282
Synonyms: 3-cyclohexyl-2-sulfanyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Sc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCCC3

STL044284
Synonyms: N-[4-hydroxy-2,6-dioxo-1-phenyl-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]acetamide
Smiles: CC(=O)NC1(C(=O)Nc2c1c(O)nc(=O)n2c1ccccc1)C(F)(F)F

STL044295
Synonyms: N'-{(Z)-[4-hydroxy-1-(3-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}pyridine-4-carbohydrazide
Smiles: Cc1cccc(c1)N1C(=O)N=C(/C(=C/NNC(=O)c2ccncc2)/C1=O)O

STL044299
Synonyms: N-ethyl-4-methyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: CCN(C(=O)c1ccc(cc1)C)Cc1cc2cc(C)ccc2[nH]c1=O

STL044311
Synonyms: N-(4-ethoxyphenyl)-2,2-dimethyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]propanamide
Smiles: CCOc1ccc(cc1)N(C(=O)C(C)(C)C)Cc1cc2ccccc2[nH]c1=O

STL044312
Synonyms: (E)-(4-chlorophenyl){2-(4-fluorophenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL044316
Synonyms: 2-{(4Z)-4-[(2-methoxyphenyl)imino]-3,4-dihydroquinazolin-2-yl}phenol
Smiles: COc1ccccc1/N=c/1\[nH]c(nc2c1cccc2)c1ccccc1O

STL044317
Synonyms: (5E)-5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-1-(2-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/Nc1c(C)n(n(c1=O)c1ccccc1)C)c1ccccc1F

STL044320
Synonyms: N-acetyl-N-[(5E)-5-(acetylimino)-4,5-dihydro-1H-tetrazol-1-yl]acetamide
Smiles: CC(=O)/N=c/1\[nH]nnn1N(C(=O)C)C(=O)C

STL044331
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Smiles: C[NH+](CCN1C(=O)C(=O)/C(=C(\c2cccs2)/[O-])/C1c1ccccc1F)C

STL044350
Synonyms: (5Z)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/NC2CCN(CC2)Cc2ccccc2)/C(=O)N1Cc1ccco1

STL044361
Synonyms: (5Z)-5-({[4-(diethylamino)phenyl]amino}methylidene)-6-hydroxy-3-(2,4,6-trimethylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CCN(c1ccc(cc1)N/C=C\1/C(=NC(=O)N(C1=O)c1c(C)cc(cc1C)C)O)CC

STL044373
Synonyms: 4-hydroxy-2-oxo-N-[(2E)-4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2(3H)-ylidene]-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: O=C(c1c(=O)[nH]c2c(c1O)CCCC2)/N=c\1/scc([nH]1)C12CC3CC(C2)CC(C1)C3

STL044374
Synonyms: 1'-methyl-2'-sulfanyl-5',6',7',8'-tetrahydro-1'H-spiro[cyclohexane-1,4'-quinazolin]-8a'(4a'H)-ol
Smiles: SC1=NC2(CCCCC2)C2C(N1C)(O)CCCC2

STL044376
Synonyms: 3-{(E)-[(2E)-(6-methyl-4-phenylquinazolin-2(3H)-ylidene)hydrazinylidene]methyl}quinolin-2(1H)-one
Smiles: Cc1ccc2c(c1)c([nH]/c(=N\N=C\c1cc3ccccc3[nH]c1=O)/n2)c1ccccc1

STL044382
Synonyms: (5E)-5-({[3-(dimethylamino)propyl]amino}methylidene)-2-sulfanyl-1-[3-(trifluoromethyl)phenyl]pyrimidine-4,6(1H,5H)-dione
Smiles: CN(CCCN/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)S)C

STL044383
Synonyms: N-(3,4-dichlorophenyl)-2-{[(2E)-4,6-dimethylpyrimidin-2(1H)-ylidene]amino}-3a,4,5,6,7,7a-hexahydro-1H-benzimidazole-1-carboxamide
Smiles: Cc1cc(C)[nH]/c(=N\C2=NC3C(N2C(=O)Nc2ccc(c(c2)Cl)Cl)CCCC3)/n1

STL044384
Synonyms: 2-ethoxy-N-[(7E)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-ylidene]aniline
Smiles: CCOc1ccccc1/N=c/1\cc(C)[nH]c2n1ncn2

STL044386
Synonyms: N-[(1Z)-4-methylphthalazin-1(2H)-ylidene]naphthalen-1-amine
Smiles: Cc1n[nH]/c(=N\c2cccc3c2cccc3)/c2c1cccc2

STL044388
Synonyms: 5-(2,3-dimethoxyphenyl)-4-hydroxy-1,3-dimethyl-3,5-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,6-dione
Smiles: COc1cccc(c1OC)C1C2=C(N=c3c1c(O)n(C)c(=O)n3C)c1c(C2=O)cccc1

STL044389
Synonyms: 8-{[(2,4-dichlorophenyl)carbonyl]oxy}-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolinium-4-carboxylate
Smiles: [O-]C(=O)C1[NH2+]c2ccc(cc2C2C1CC=C2)OC(=O)c1ccc(cc1Cl)Cl

STL044401
Synonyms: (E)-[2-(4-hydroxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](4-methoxy-3-methylphenyl)methanolate
Smiles: COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)Cc1ccc[nH+]c1)/[O-]

STL044410
Synonyms: (5Z)-3-[2-(cyclohex-1-en-1-yl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/NCC2CCCO2)/C(=O)N1CCC1=CCCCC1

STL044429
Synonyms: 4-ethoxy-N-(4-hydroxy-2-oxo-1,2-dihydropyrimidin-5-yl)benzamide
Smiles: CCOc1ccc(cc1)C(=O)Nc1c[nH]c(=O)nc1O

STL044432
Synonyms: 2-{(E)-[2-({4-[(4-bromophenyl)sulfonyl]piperazin-1-ium-1-yl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: O=C(C[NH+]1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1ccccc1C(=O)[O-]

STL044435
Synonyms: N-(1-hydroxy-2-methylpropan-2-yl)-2-methyl-5-{(4Z)-4-[(2-methylphenyl)imino]-3,4-dihydrophthalazin-1-yl}benzenesulfonamide
Smiles: OCC(NS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N\c2ccccc2C)/c2c1cccc2)(C)C

STL044440
Synonyms: methyl2-[({[(5Z)-5-{[(2-chlorophenyl)carbonyl]imino}-4,5-dihydro-1,3,4-thiadiazol-2-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CSc1n[nH]/c(=N/C(=O)c2ccccc2Cl)/s1

STL044465
Synonyms: (5Z)-5-[4-(dimethylamino)benzylidene]-4-sulfanyl-1,3-oxazole-2(5H)-thione
Smiles: CN(c1ccc(cc1)/C=C/1\OC(=S)N=C1S)C

STL044477
Synonyms: (4E)-5-(3-ethoxy-4-hydroxyphenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccc(c(c1)OCC)O

STL044479
Synonyms: pentyl2-(4-hydroxy-6-methyl-2-sulfanylpyrimidin-5-yl)propanoate
Smiles: CCCCCOC(=O)C(c1c(C)nc(nc1O)S)C

STL044481
Synonyms: 6-chloro-3-ethyl-4-methyl-2-oxo-8-(piperidinium-1-ylmethyl)-2H-chromen-7-olate
Smiles: CCc1c(=O)oc2c(c1C)cc(c(c2C[NH+]1CCCCC1)[O-])Cl

STL044485
Synonyms: 2-(4-{[(1E)-4-[3-(dimethylsulfamoyl)-4-methylphenyl]phthalazin-1(2H)-ylidene]amino}phenoxy)-N-methylacetamide
Smiles: CNC(=O)COc1ccc(cc1)/N=c\1/[nH]nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N(C)C)C

STL044491
Synonyms: 4-[({[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)[O-])[nH+]nc1c1cccnc1

STL044499
Synonyms: 4-{[(E)-(1-cyclopropyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]amino}benzoicacid
Smiles: OC(=O)c1ccc(cc1)N/C=C/1\C(=O)N=C(N(C1=O)C1CC1)S

STL044501
Synonyms: 6,8-dimethyl-2,5-dihydro-3H-[1,2,4]triazino[5,6-b]indole-3-thione
Smiles: Cc1cc(C)c2c(c1)c1n[nH]c(=S)nc1[nH]2

STL044502
Synonyms: (2Z)-2-(1H-benzimidazol-2-yl)-3-hydroxy-3-(thiophen-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C(\c1cccs1)/O)/c1nc2c([nH]1)cccc2

STL044505
Synonyms:
Smiles: OC(=O)c1cc(cc(c1)C(=O)O)NS(=O)(=O)c1cccc2c1nsn2

STL044506
Synonyms: (E)-(4-fluorophenyl){1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL044508
Synonyms: 1-[(E)-amino{[(2Z)-4,6,7-trimethylquinazolin-2(3H)-ylidene]amino}methylidene]-3-cyclohexylurea
Smiles: N/C(=N\C(=O)NC1CCCCC1)/N=c\1/[nH]c(C)c2c(n1)cc(c(c2)C)C

STL044519
Synonyms: 2-(8,9-diphenylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-1-ium-2-yl)naphthalen-1-olate
Smiles: [O-]c1c(ccc2c1cccc2)c1[nH+]c2n(n1)cnc1c2c(c2ccccc2)c(o1)c1ccccc1

STL044530
Synonyms: 3-{5-[(4-chlorophenyl)ammonio]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoate
Smiles: [O-]C(=O)CCN1C(=O)SC(C1=O)[NH2+]c1ccc(cc1)Cl

STL044536
Synonyms: [(3E)-3-[hydroxy(phenyl)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]aceticacid
Smiles: OC(=O)CN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)C

STL044544
Synonyms: (5Z)-5-({[3-(diethylamino)propyl]amino}methylidene)-3-(3,4-dimethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCN(CCCN/C=C\1/C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)O)CC

STL044574
Synonyms: 2-methoxy-N-(5-methyl-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide
Smiles: COc1ccccc1C(=O)Nc1nn2c(=NC(=CC2c2ccccc2)C)[nH]1

STL044584
Synonyms: 1-(4-ethoxyphenyl)-3-[(2E)-4-hydroxy-5,6,7,8-tetrahydroquinazolin-2(1H)-ylidene]guanidine
Smiles: CCOc1ccc(cc1)NC(=N)/N=c\1/nc(O)c2c([nH]1)CCCC2

STL044590
Synonyms: ethyl(2Z)-4-methyl-2-({[(morpholin-4-ylcarbonothioyl)sulfanyl]acetyl}imino)-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1s/c(=N\C(=O)CSC(=S)N2CCOCC2)/[nH]c1C

STL044595
Synonyms: (5Z)-1-acetyl-5-[(2-hydroxy-6-methoxyquinolin-3-yl)methylidene]-2-sulfanyl-1,5-dihydro-4H-imidazol-4-one
Smiles: COc1ccc2c(c1)cc(c(n2)O)/C=C\1/C(=O)N=C(N1C(=O)C)S

STL044596
Synonyms: 1-(2-{[(2E)-4,6-dimethylquinazolin-2(1H)-ylidene]amino}-4-methylpyrimidin-5-yl)ethanone
Smiles: Cc1ccc2c(c1)c(C)n/c(=N/c1ncc(c(n1)C)C(=O)C)/[nH]2

STL044601
Synonyms: N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)carbamimidoyl]-2-methylpropanamide
Smiles: O=C(C(C)C)N/C(=N\c1ccc(cc1)F)/Nc1nc(C)cc(n1)C

STL044614
Synonyms: (E)-[2-(4-chlorophenyl)-4,5-dioxo-1-(pyridinium-2-yl)pyrrolidin-3-ylidene](4-methoxyphenyl)methanolate
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Cl)c1cccc[nH+]1)/[O-]

STL044617
Synonyms: 2-{[(2E)-4,7-dimethylquinazolin-2(3H)-ylidene]amino}-7,8-dihydroquinazolin-5(6H)-one
Smiles: Cc1ccc2c(c1)n/c(=N/c1ncc3c(n1)CCCC3=O)/[nH]c2C

STL044621
Synonyms: methyl6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-(4-chlorophenyl)-5-cyano-2-hydroxy-3,4-dihydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)NCc1ccccc1)O

STL044628
Synonyms: 2-(4,6-dimethylpyrimidin-2-yl)-1-[2-(4-methoxyphenyl)ethyl]guanidine
Smiles: COc1ccc(cc1)CCN/C(=N/c1nc(C)cc(n1)C)/N

STL044631
Synonyms: 6-bromo-4-phenyl-3-(piperidin-1-ylmethyl)quinolin-2-ol
Smiles: Brc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)CN1CCCCC1

STL044632
Synonyms: 4-hydroxy-N-(3-hydroxypyridin-2-yl)-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Smiles: O=C(c1c(O)n2CCc3c2c(c1=O)ccc3)Nc1ncccc1O

STL044649
Synonyms: (2Z)-1-(2,4-dimethyl-1,3-oxazol-5-yl)-2-(3-hydroxyquinoxalin-2(1H)-ylidene)ethanone
Smiles: Cc1nc(c(o1)C(=O)/C=c/1\[nH]c2ccccc2nc1O)C

STL044652
Synonyms: 3-[(1Z)-2-hydroxy-3,3-dimethylbut-1-en-1-yl]-6-methyl-2H-1,4-benzoxazin-2-one
Smiles: Cc1ccc2c(c1)nc(c(=O)o2)/C=C(/C(C)(C)C)\O

STL044656
Synonyms: 4-bromo-2-{[(1-propyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate
Smiles: CCCn1c(NCc2cc(Br)ccc2[O-])[nH+]c2c1cccc2

STL044657
Synonyms: {2-[(Z)-(1-cyclohexyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccccc1/C=C\1/C(=NC(=O)N(C1=O)C1CCCCC1)O

STL044659
Synonyms: 2-(4-{[(1Z)-4-{3-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methylphenyl}phthalazin-1(2H)-ylidene]amino}phenoxy)acetamide
Smiles: OCC(NS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N\c2ccc(cc2)OCC(=O)N)/c2c1cccc2)(C)C

STL044670
Synonyms: 2,6-di-tert-butyl-4-[(E)-(2-{[(4-methyl-4H-1,2,4-triazol-2-ium-3-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenolate
Smiles: O=C(CSc1[nH+]ncn1C)N/N=C/c1cc(c(c(c1)C(C)(C)C)[O-])C(C)(C)C

STL044685
Synonyms: 8-{[2-(diethylamino)ethyl]amino}-6-hydroxy-3-methyl-3,9-dihydro-2H-purin-2-one
Smiles: CCN(CCNc1nc2c([nH]1)n(C)c(=O)nc2O)CC

STL044690
Synonyms: N-[4-cyano-2-hydroxy-5-methyl-3-(trifluoromethyl)-3H-pyrrol-3-yl]-4-(propan-2-yloxy)benzamide
Smiles: N#CC1=C(C)N=C(C1(NC(=O)c1ccc(cc1)OC(C)C)C(F)(F)F)O

STL044701
Synonyms: 2-{[(7E)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-ylidene]amino}benzoicacid
Smiles: OC(=O)c1ccccc1/N=c/1\cc(C)[nH]c2n1ncn2

STL044710
Synonyms: 4-chloro-2-{1-[(1-ethyl-1H-benzimidazol-3-ium-2-yl)amino]ethyl}phenolate
Smiles: CCn1c(NC(c2cc(Cl)ccc2[O-])C)[nH+]c2c1cccc2

STL044718
Synonyms: 2,4-dibromo-6-{[(1-ethyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate
Smiles: CCn1c(NCc2cc(Br)cc(c2[O-])Br)[nH+]c2c1cccc2

STL044721
Synonyms: 2-fluoro-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-methylbenzamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1ccccc1F)C

STL044722
Synonyms: N-[N'-(4-fluorophenyl)-N-(4-oxo-6-propyl-1,4-dihydropyrimidin-2-yl)carbamimidoyl]benzamide
Smiles: CCCc1cc(=O)nc([nH]1)N/C(=N\c1ccc(cc1)F)/NC(=O)c1ccccc1

STL044728
Synonyms: (5E)-1-ethyl-5-[(morpholin-4-ylamino)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=NC(=O)/C(=C\NN2CCOCC2)/C1=O)S

STL044737
Synonyms: (2E)-5,5-bis(hydroxymethyl)-2-[(3-hydroxyphenyl)imino]-2,5-dihydro-1,3-thiazol-4-ol
Smiles: OCC1(CO)S/C(=N/c2cccc(c2)O)/N=C1O

STL044738
Synonyms: 2-methylpyrimido[1,2-a]benzimidazol-4(10H)-one
Smiles: Cc1cc(=O)n2c(n1)[nH]c1c2cccc1

STL044745
Synonyms: N'-{(E)-[1-(2,5-dimethoxyphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-2-hydroxybenzohydrazide
Smiles: COc1ccc(c(c1)N1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2O)/C1=O)S)OC

STL044751
Synonyms: (5Z)-5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-1-phenyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\C=C\c1ccco1)c1ccccc1

STL044764
Synonyms: 6-hydroxy-3-methyl-8-{[2-(piperidin-1-yl)ethyl]sulfanyl}-7-(prop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: C=CCn1c(SCCN2CCCCC2)nc2c1c(O)nc(=O)n2C

STL044769
Synonyms: (2Z)-4,6-diphenyl-2-[(2Z)-(pyridin-4-ylmethylidene)hydrazinylidene]-1,2-dihydropyrimidine
Smiles: n1ccc(cc1)/C=N\N=c\1/nc(cc([nH]1)c1ccccc1)c1ccccc1

STL044787
Synonyms: 3-fluoro-N-[(4E)-1-(3-methylphenyl)-1,7-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-ylidene]aniline
Smiles: Fc1cccc(c1)/N=c\1/nc[nH]c2c1cnn2c1cccc(c1)C

STL044792
Synonyms: 1-benzyl-2-hydroxy-4-oxo-N-(pyridin-4-yl)-1,4-dihydroquinoline-3-carboxamide
Smiles: O=C(c1c(=O)c2ccccc2n(c1O)Cc1ccccc1)Nc1ccncc1

STL044799
Synonyms: 2-(5-bromo-2,3-dihydroxy-3H-indol-3-yl)cyclohexanone
Smiles: O=C1CCCCC1C1(O)C(=Nc2c1cc(Br)cc2)O

STL044809
Synonyms: (2-{(Z)-[1-(4-fluorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}phenoxy)aceticacid
Smiles: OC(=O)COc1ccccc1/C=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)F)O

STL044814
Synonyms: (3E)-1-(5-bromo-2,3-dihydroxy-3H-indol-3-yl)-4-(furan-2-yl)but-3-en-2-one
Smiles: O=C(CC1(O)C(=Nc2c1cc(Br)cc2)O)/C=C/c1ccco1

STL044835
Synonyms: 1-butyl-2-hydroxy-4-oxo-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCn1c(O)c(C(=O)NC23CC4CC(C3)CC(C2)C4)c(=O)c2c1cccc2

STL044838
Synonyms: 2-methyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-phenylpropanamide
Smiles: CC(C(=O)N(c1ccccc1)Cc1cc2ccccc2[nH]c1=O)C

STL044841
Synonyms: (E)-(4-methoxyphenyl)[2-(4-nitrophenyl)-4,5-dioxo-1-(pyridinium-2-yl)pyrrolidin-3-ylidene]methanolate
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1cccc[nH+]1)/[O-]

STL044854
Synonyms: 2-methoxy-6-{[(1-propyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate
Smiles: CCCn1c(NCc2cccc(c2[O-])OC)[nH+]c2c1cccc2

STL044858
Synonyms: (E)-(2-methylimidazo[1,2-a]pyridin-3-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}methanolate
Smiles: O=C1C(=O)N(C(/C/1=C(/c1c(C)nc2n1cccc2)\[O-])c1cccs1)CC[NH+]1CCOCC1

STL044859
Synonyms: (5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(4-methylpiperazin-1-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CN1CCN(CC1)N/C=C/1\C(=O)N=C(N(C1=O)CCC1=CCCCC1)S

STL044860
Synonyms: 2-(3,4-dimethoxybenzyl)-5,5,7-trimethyl-5,6-dihydro-2H-1,2,4-triazepine-3-thiol
Smiles: COc1cc(ccc1OC)CN1N=C(C)CC(N=C1S)(C)C

STL044864
Synonyms: ethyl6-({2-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(2-ethoxyphenyl)-2-hydroxy-3,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)C1C(=NC(=C(C1c1ccccc1OCC)C#N)SCC(=O)Nc1cc(OC)c(cc1OC)Cl)O

STL044891
Synonyms: 3-fluoro-N-[(4E)-2-(pyridin-4-yl)quinazolin-4(3H)-ylidene]aniline
Smiles: Fc1cccc(c1)/N=c\1/[nH]c(nc2c1cccc2)c1ccncc1

STL044893
Synonyms: (5E)-5-(2-oxo-2-phenylethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
Smiles: O=C(c1ccccc1)/C=C\1/N=C(NC1=O)S

STL044899
Synonyms: 4-{3-[(1R,2R)-2-phenylcyclopropyl]-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)n1c(n[nH]c1=S)[C@@H]1C[C@H]1c1ccccc1

STL044902
Synonyms: 2,4-dichloro-6-{[(1-methyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate
Smiles: Clc1cc(CNc2[nH+]c3c(n2C)cccc3)c(c(c1)Cl)[O-]

STL044903
Synonyms: 1-[2-(cyclohex-1-en-1-yl)ethyl]-5-[{1-[2-(cyclohex-1-en-1-yl)ethyl]-4,6-dihydroxy-2-thioxo-1,2-dihydropyrimidin-5-yl}(4-methoxy-3-{[2-(pyridin-3-yl)piperidinium-1-yl]methyl}phenyl)methyl]-4-hydroxy-6-
Smiles: COc1ccc(cc1C[NH+]1CCCCC1c1cccnc1)C(c1c(O)nc(n(c1=O)CCC1=CCCCC1)[S-])c1c(O)nc(=S)n(c1O)CCC1=CCCCC1

STL044912
Synonyms: 7-(4-chlorophenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5(3H)-one
Smiles: O=C1CC(c2ccc(cc2)Cl)n2c(=N1)[nH]cn2

STL044915
Synonyms: 2-{[4-(1,3-benzodioxol-5-yl)-3-cyano-6-hydroxy-4,5-dihydropyridin-2-yl]sulfanyl}-N-(4-bromophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Br)N=C(CC1c1ccc2c(c1)OCO2)O

STL044918
Synonyms: (5E)-6-hydroxy-2-sulfanyl-5-(2,3,4-trimethoxybenzylidene)pyrimidin-4(5H)-one
Smiles: COc1ccc(c(c1OC)OC)/C=C/1\C(=NC(=NC1=O)S)O

STL044923
Synonyms: 5-(furan-2-yl)-4-{[(E)-(4-methylphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccco1

STL044924
Synonyms: 2-{(6Z)-6-[(4-chlorophenyl)imino]-4-methyl-1,6-dihydropyrimidin-2-yl}phenol
Smiles: Clc1ccc(cc1)/N=c\1/cc(C)nc([nH]1)c1ccccc1O

STL044925
Synonyms: N-[(1Z)-8,8-dimethyl-5-(morpholin-4-yl)-8,9-dihydro-6H-pyrano[4,3-d][1,2]thiazolo[5,4-b]pyridin-1(2H)-ylidene]benzamide
Smiles: O=C(c1ccccc1)/N=c/1\[nH]sc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1

STL044954
Synonyms: N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylphenyl)benzamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(c1ccccc1C)C(=O)c1ccccc1

STL044960
Synonyms: (5E)-1-ethyl-5-[(5-nitrothiophen-2-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=NC(=O)/C(=C\c2ccc(s2)[N+](=O)[O-])/C1=O)S

STL044962
Synonyms: 1-[(E)-{2-[(4-benzylpiperazin-1-ium-1-yl)acetyl]hydrazinylidene}methyl]naphthalen-2-olate
Smiles: O=C(C[NH+]1CCN(CC1)Cc1ccccc1)N/N=C/c1c([O-])ccc2c1cccc2

STL044964
Synonyms: (6Z)-6-[(2E)-(2,5-dimethoxybenzylidene)hydrazinylidene]-5,6-dihydro[1,2,4]triazolo[3,4-a]phthalazine
Smiles: COc1ccc(cc1/C=N/N=c/1\[nH]n2cnnc2c2c1cccc2)OC

STL044966
Synonyms: 1-(4-{[(2E)-4-hydroxy-1,3-thiazol-2(5H)-ylidene]amino}phenyl)ethanone
Smiles: CC(=O)c1ccc(cc1)/N=C\1/SCC(=N1)O

STL044969
Synonyms: propyl{[4-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-cyano-6-hydroxy-4,5-dihydropyridin-2-yl]sulfanyl}acetate
Smiles: CCCOC(=O)CSC1=C(C#N)C(CC(=N1)O)c1cc(Br)c(c(c1)OC)O

STL044971
Synonyms: 4-chloro-N-(2,4-dimethylphenyl)-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: Cc1ccc(c(c1)C)N(C(=O)c1ccc(cc1)Cl)Cc1cc2cccc(c2[nH]c1=O)C

STL044972
Synonyms: (5E)-5-(3,4-dimethoxybenzylidene)-6-hydroxy-2-sulfanylpyrimidin-4(5H)-one
Smiles: COc1ccc(cc1OC)/C=C/1\C(=NC(=NC1=O)S)O

STL044986
Synonyms: (5Z)-6-hydroxy-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-2-sulfanylpyrimidin-4(5H)-one
Smiles: SC1=NC(=O)/C(=C\c2cccn2C)/C(=N1)O

STK936897
Synonyms: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)acetamide
Smiles: O=C(Cc1c(C)noc1C)Nc1ccc(cc1)F

STK940009
Synonyms: 3-amino-1-(pyrrolidin-1-yl)propan-1-one
Smiles: NCCC(=O)N1CCCC1

STK942247
Synonyms: 3-amino-1-(4-phenylpiperazin-1-yl)propan-1-one
Smiles: NCCC(=O)N1CCN(CC1)c1ccccc1

STK942944
Synonyms: 1-(1H-indol-2-yl)ethanone
Smiles: CC(=O)c1cc2c([nH]1)cccc2

STK943379
Synonyms: [(3,4-dichlorophenyl)sulfonyl]acetonitrile
Smiles: N#CCS(=O)(=O)c1ccc(c(c1)Cl)Cl

STL008905
Synonyms: [3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetonitrile
Smiles: N#CCc1onc(n1)c1ccc(cc1)OC

STL044997
Synonyms: 3-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(3-fluorophenyl)-4,5-dioxopyrrolidin-1-yl]propanoicacid
Smiles: OC(=O)CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1cccc(c1)F

STL045007
Synonyms: N-(2-hydroxyethyl)-4-{[(4-hydroxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}benzamide
Smiles: OCCNC(=O)c1ccc(cc1)CSc1nc(O)c2c(n1)sc1c2CCCC1

STL045009
Synonyms: 2,4-dibromo-6-{[(1-butyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate
Smiles: CCCCn1c(NCc2cc(Br)cc(c2[O-])Br)[nH+]c2c1cccc2

STL045021
Synonyms: N-[(2Z,5Z)-4-hydroxy-5-(5-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-1,3-thiazol-2(5H)-ylidene]-4-methylbenzenesulfonamide
Smiles: COc1ccc2c(c1)/C(=C\1/S/C(=N\S(=O)(=O)c3ccc(cc3)C)/N=C1O)/C(=O)N2

STL045034
Synonyms: N-(4-chlorobenzyl)-2,4-dihydroxy-5,6,7,8-tetrahydroquinoline-3-carboxamide
Smiles: Clc1ccc(cc1)CNC(=O)c1c(O)nc2c(c1O)CCCC2

STL045048
Synonyms: (3Z)-3-[(2E)-(thiophen-2-ylmethylidene)hydrazinylidene]-4,5-dihydro-3H-[1,2,4]triazino[5,6-b]indole
Smiles: c1csc(c1)/C=N/N=c/1\nnc2c([nH]1)[nH]c1c2cccc1

STL045079
Synonyms: 5-(1H-pyrazol-2-ium-1-ylmethyl)furan-2-carboxylate
Smiles: [O-]C(=O)c1ccc(o1)Cn1ccc[nH+]1

STL045082
Synonyms: 9-(methylsulfanyl)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclohexan]-7(11H)-one
Smiles: CSc1n[nH]c2n1c(=O)c1c(n2)c2ccccc2CC21CCCCC2

STL045097
Synonyms: (E)-[2-(3-bromophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene][5-(methoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Smiles: COC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Br)Cc1ccc[nH+]c1)/[O-])C

STL045106
Synonyms: 8-amino-6-hydroxy-3-methyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-2H-purin-2-one
Smiles: Oc1nc(=O)n(c2c1n(Cc1cccc3c1cccc3)c(n2)N)C

STL045110
Synonyms: 4-chloro-N-[(2Z)-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2(1H)-ylidene]aniline
Smiles: Clc1ccc(cc1)/N=c/1\[nH]c2ccccc2nc1n1nc(cc1C)C

STL045118
Synonyms: N-(5,7-diphenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)butanamide
Smiles: CCCC(=O)Nc1nn2c(=NC(=CC2c2ccccc2)c2ccccc2)[nH]1

STL045120
Synonyms: N-[2-hydroxy-5-oxo-1-(3-phenylpropyl)-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]furan-2-carboxamide
Smiles: OC1=NC(C(=O)N1CCCc1ccccc1)(NC(=O)c1ccco1)C(F)(F)F

STL045122
Synonyms: 4-[(5,7-diphenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)amino]-4-oxobutanoicacid
Smiles: O=C(Nc1nn2c(=NC(=CC2c2ccccc2)c2ccccc2)[nH]1)CCC(=O)O

STL045124
Synonyms: N'-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}benzohydrazide
Smiles: C=CCN1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2)/C1=O)S

STL045125
Synonyms: 2-{[(2E)-6-ethoxy-4-methylquinazolin-2(3H)-ylidene]amino}-1-methylquinazolin-4(1H)-one
Smiles: CCOc1ccc2c(c1)c(C)[nH]/c(=N\c1nc(=O)c3c(n1C)cccc3)/n2

STL045127
Synonyms: (6Z)-6-{(2E)-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinylidene}-5,6-dihydro[1,2,4]triazolo[3,4-a]phthalazine
Smiles: Cc1nn(c(c1/C=N/N=c/1\[nH]n2cnnc2c2c1cccc2)C)c1ccccc1

STL045129
Synonyms: 4-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(2,4-dimethoxyphenyl)-4,5-dioxopyrrolidin-1-yl]butanoicacid
Smiles: COc1ccc(c(c1)OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CCCC(=O)O

STL045132
Synonyms: (E)-(3-methoxyphenyl)[2-(5-methylfuran-2-yl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(o1)C)Cc1ccc[nH+]c1)/[O-]

STL045150
Synonyms: 1-(4-methoxyphenyl)-3-[(2Z)-5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: COc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)COc1cc(C)ccc1C(C)C

STL045157
Synonyms: 2-[(5-ethyl-4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]acetamide
Smiles: CCc1c(C)nc([nH]c1=O)SCC(=O)NC(C12CC3CC(C2)CC(C1)C3)C

STL045158
Synonyms: (E)-[4,5-dioxo-2-phenyl-1-(pyrimidin-1-ium-2-yl)pyrrolidin-3-ylidene](4-fluorophenyl)methanolate
Smiles: Fc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)c1nccc[nH+]1)/[O-]

STL045165
Synonyms: (2Z)-2-[(2E)-(2,3-dimethoxybenzylidene)hydrazinylidene]-4-methyl-1,2-dihydroquinoline
Smiles: COc1c(cccc1OC)/C=N/N=c\1/cc(C)c2c([nH]1)cccc2

STL045170
Synonyms: (2-oxo-1,2-dihydroquinolin-3-yl)methyl2-fluorobenzoate
Smiles: O=C(c1ccccc1F)OCc1cc2ccccc2[nH]c1=O

STL045173
Synonyms: 3-[(ethylamino)methyl]quinolin-2(1H)-one
Smiles: CCNCc1cc2ccccc2[nH]c1=O

STL045179
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}(phenyl)methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccccc2)/[O-])/C(N1CCCn1c[nH+]cc1)c1cccs1

STL045189
Synonyms: 1-(4-fluorophenyl)-4-hydroxy-7-(thiophen-2-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Smiles: Fc1ccc(cc1)n1c(=O)nc(c2c1NC(=NC2(C(F)(F)F)C(F)(F)F)c1cccs1)O

STL045194
Synonyms: (E)-{1-[3-(dimethylammonio)propyl]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[5-(methoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Smiles: COc1ccc(cc1)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1c(C)[nH]c(c1C)C(=O)OC)/[O-]

STL045208
Synonyms: N-(biphenyl-4-yl)-4-methyl-1-(3-methylphenyl)-4,7-dihydro-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Smiles: Cc1cccc(c1)n1ncc2c1NC=NC2(C)Nc1ccc(cc1)c1ccccc1

STL045219
Synonyms: 3-{(3E)-2-(3-fluorophenyl)-3-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-4,5-dioxopyrrolidin-1-yl}benzoicacid
Smiles: Fc1cccc(c1)C1N(c2cccc(c2)C(=O)O)C(=O)C(=O)/C/1=C(\C=C\c1ccccc1)/O

STL045221
Synonyms: N'-{(E)-[1-(4-ethoxyphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-2-hydroxybenzohydrazide
Smiles: CCOc1ccc(cc1)N1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2O)/C1=O)S

STL045225
Synonyms: (E)-furan-2-yl[2-(4-methylphenyl)-4,5-dioxo-1-(pyrimidin-1-ium-2-yl)pyrrolidin-3-ylidene]methanolate
Smiles: Cc1ccc(cc1)C1/C(=C(/c2ccco2)\[O-])/C(=O)C(=O)N1c1nccc[nH+]1

STL045234
Synonyms: N'-(benzo[cd]indol-2-yl)-2-chlorobenzohydrazide
Smiles: O=C(c1ccccc1Cl)NNC1=Nc2c3c1cccc3ccc2

STL045243
Synonyms: 2-{[3-cyano-6-hydroxy-4-(2-methoxyphenyl)-4,5-dihydropyridin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)F)N=C(CC1c1ccccc1OC)O

STL045248
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(3-ethoxy-4-hydroxyphenyl)-1-(tetrahydrofuran-2-ylmethyl)pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1O)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CC1CCCO1

STL045252
Synonyms: 6-[1,3-benzodioxol-5-yl(5-hydroxy-7-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)methyl]-7-hydroxy-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Smiles: O=c1nc2SCCn2c(c1C(c1c(O)nc2n(c1=O)CCS2)c1ccc2c(c1)OCO2)O

STL045270
Synonyms: 4-{[(E)-(4-chlorophenyl)methylidene]amino}-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccncc1

STL045271
Synonyms: 4-[(E)-{2-[(4-benzylpiperazin-1-ium-1-yl)acetyl]hydrazinylidene}methyl]-2-methoxyphenolate
Smiles: COc1cc(/C=N/NC(=O)C[NH+]2CCN(CC2)Cc2ccccc2)ccc1[O-]

STL045275
Synonyms: N-(2,3-dimethylphenyl)-2-hydroxy-6-(4-methoxyphenyl)-4-methyl-1,6-dihydropyrimidine-5-carboxamide
Smiles: COc1ccc(cc1)C1NC(=NC(=C1C(=O)Nc1cccc(c1C)C)C)O

STL045283
Synonyms: N-{N'-[4-(benzyloxy)phenyl]-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl}-2-phenylbutanamide
Smiles: CCC(C(=O)N/C(=N\c1ccc(cc1)OCc1ccccc1)/Nc1nc(C)cc(n1)C)c1ccccc1

STL045285
Synonyms: 6-hydroxy-8-[(4-methoxybenzyl)amino]-3-methyl-7-(prop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: C=CCn1c(NCc2ccc(cc2)OC)nc2c1c(O)nc(=O)n2C

STL045292
Synonyms: (5E)-5-({[2-(dimethylamino)ethyl]amino}methylidene)-1-(3-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CN(CCN/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C)S)C

STL045298
Synonyms: (4E)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(4-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)O)c1nc(c(s1)C)C)/O

STL045339
Synonyms: 4-iodo-N-[(4E)-1-methyl-1,7-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-ylidene]aniline
Smiles: Ic1ccc(cc1)/N=c\1/nc[nH]c2c1cnn2C

STL045346
Synonyms: 2-[(pyridinium-2-ylamino)methyl]phenolate
Smiles: [O-]c1ccccc1CNc1cccc[nH+]1

STL045372
Synonyms: N'-[(E)-(4-fluorophenyl)methylidene]-2,4-dihydroxy-5,6,7,8-tetrahydroquinoline-3-carbohydrazide
Smiles: Fc1ccc(cc1)/C=N/NC(=O)c1c(O)nc2c(c1O)CCCC2

STL045380
Synonyms: 7-(3,4-dimethoxyphenyl)-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1cc(ccc1OC)C1C=C(N=c2n1nc[nH]2)c1ccccc1

STL045382
Synonyms: 6-ethyl-6-methyl-6,11-dihydrobenzo[h]tetrazolo[5,1-b]quinazolin-7(5H)-one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n1c(n2)[nH]nn1

STL045395
Synonyms: 6-hydroxy-8-[(2-hydroxyethyl)amino]-3-methyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-2H-purin-2-one
Smiles: OCCNc1nc2c(n1Cc1cccc3c1cccc3)c(O)nc(=O)n2C

STL045409
Synonyms: 3-[(Z)-(5-hydroxy-2-sulfanyl-4H-imidazol-4-ylidene)methyl]-7-methoxyquinolin-2(1H)-one
Smiles: COc1ccc2c(c1)[nH]c(=O)c(c2)/C=C/1\N=C(N=C1O)S

STL045410
Synonyms: (E)-[2-(4-methoxyphenyl)-4,5-dioxo-1-(pyridinium-3-yl)pyrrolidin-3-ylidene](phenyl)methanolate
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1c1ccc[nH+]c1

STL045412
Synonyms: methyl3-{[(1-hexyl-2-hydroxy-4-oxo-1,4-dihydroquinolin-3-yl)carbonyl]amino}thiophene-2-carboxylate
Smiles: CCCCCCn1c(O)c(C(=O)Nc2ccsc2C(=O)OC)c(=O)c2c1cccc2

STL045413
Synonyms: 2-{[2-(dimethylamino)ethyl]sulfanyl}-5-phenylpyrimidine-4,6-diol
Smiles: CN(CCSc1nc(O)c(c(n1)O)c1ccccc1)C

STL045417
Synonyms: N-[(2Z)-6-bromo-4-phenylquinazolin-2(1H)-ylidene]-1,3-benzothiazol-2-amine
Smiles: Brc1ccc2c(c1)c(n/c(=N\c1nc3c(s1)cccc3)/[nH]2)c1ccccc1

STL045423
Synonyms: 6-hydroxy-N-[(2E)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Smiles: Cc1n[nH]/c(=N\C(=O)c2c(O)c3cccc4c3n(c2=O)CC4)/s1

STL045430
Synonyms: (5Z)-5-(furan-2-ylmethylidene)-1-phenyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: SC1=NC(=O)/C(=C/c2ccco2)/C(=O)N1c1ccccc1

STL045437
Synonyms: 5-(propan-2-yl)-N'-[(1Z)-1-(thiophen-2-yl)ethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)C(C)C)N/N=C(\c1cccs1)/C

STL045444
Synonyms: (5Z)-3-(3-chloro-4-methylphenyl)-5-[4-(diethylamino)benzylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCN(c1ccc(cc1)/C=C\1/C(=NC(=O)N(C1=O)c1ccc(c(c1)Cl)C)O)CC

STL045447
Synonyms: 2-hydroxy-N'-[(2Z)-4-oxo-4-(pyridin-3-yl)butan-2-ylidene]benzohydrazide
Smiles: C/C(=N/NC(=O)c1ccccc1O)/CC(=O)c1cccnc1

STL045467
Synonyms: 7-benzyl-2-(morpholin-4-yl)-7H-purin-6-ol
Smiles: Oc1nc(nc2c1n(cn2)Cc1ccccc1)N1CCOCC1

STL045470
Synonyms: 4-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-2-ethoxyphenyl4-fluorobenzoate
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CSC2=NCCS2)c2nonc2N)ccc1OC(=O)c1ccc(cc1)F

STL045476
Synonyms: N-[1-(4-fluorophenyl)-4-hydroxy-2,6-dioxo-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]pyridine-3-carboxamide
Smiles: Fc1ccc(cc1)n1c(=O)nc(c2c1NC(=O)C2(NC(=O)c1cccnc1)C(F)(F)F)O

STL045488
Synonyms: 2-ethyl-N-[(7E)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-ylidene]aniline
Smiles: CCc1ccccc1/N=c/1\cc(C)[nH]c2n1ncn2

STL045501
Synonyms: 4-{[5-(4-chlorophenyl)-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]amino}-4-oxobutanoicacid
Smiles: O=C(Nc1nn2c(=NC(=CC2c2ccccc2)c2ccc(cc2)Cl)[nH]1)CCC(=O)O

STL045506
Synonyms: 6-amino-3-{[(4-methylphenyl)sulfanyl]methyl}-4-(pyridin-3-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccnc1)c(CSc1ccc(cc1)C)n[nH]2

STL045513
Synonyms: 2-amino-8-(morpholin-4-yl)-7H-purin-6-ol
Smiles: Nc1nc2nc([nH]c2c(n1)O)N1CCOCC1

STL045519
Synonyms: (E)-{2-(5-methylfuran-2-yl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Smiles: Cc1ccc(o1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccccc1)/[O-]

STL045536
Synonyms: (5E)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C(=O)N1C

STL045546
Synonyms: (6-bromo-5-methyl-7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)aceticacid
Smiles: OC(=O)Cc1nn2c([nH]1)nc(c(c2=O)Br)C

STL045554
Synonyms: (5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-({[3-(morpholin-4-yl)propyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/NCCCN1CCOCC1)CCC1=CCCCC1

STL045557
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Smiles: Cc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)CCCn1cc[nH+]c1)/[O-]

STL045560
Synonyms: 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea
Smiles: O=C(N(C)C)Nc1n[nH]nn1

STL045562
Synonyms: 7-[4-({[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}carbamothioyl)piperazin-1-ium-1-yl]-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
Smiles: CCn1cc(C(=O)[O-])c(=O)c2c1cc(c(c2)F)[NH+]1CCN(CC1)C(=S)NC(=O)c1c(C)onc1c1c(Cl)cccc1Cl

STL045573
Synonyms: 3-{(3E)-2-(2-fluorophenyl)-3-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-4,5-dioxopyrrolidin-1-yl}benzoicacid
Smiles: OC(=O)c1cccc(c1)N1C(=O)C(=O)/C(=C(\C=C\c2ccccc2)/O)/C1c1ccccc1F

STL045584
Synonyms: 3-hydroxy-4-[(E)-(2-{[4-(4-methylbenzyl)piperazin-1-ium-1-yl]acetyl}hydrazinylidene)methyl]phenolate
Smiles: Cc1ccc(cc1)CN1CC[NH+](CC1)CC(=O)N/N=C/c1ccc(cc1O)[O-]

STL045585
Synonyms: [(4,6-dihydroxy-5-propylpyrimidin-2-yl)sulfanyl]aceticacid
Smiles: CCCc1c(O)nc(nc1O)SCC(=O)O

STL045593
Synonyms: 5-(4-chlorophenyl)-7-(2,4-dichlorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Clc1ccc(cc1)C1=CC(n2c(=N1)[nH]cn2)c1ccc(cc1Cl)Cl

STL045595
Synonyms: N,N'-(2-phenyl-2,4-dihydro-3H-1,2,4-triazol-5-yl-3-ylidene)diacetamide
Smiles: CC(=O)Nc1nn(/c(=N/C(=O)C)/[nH]1)c1ccccc1

STL045604
Synonyms: 3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)-N'-{(E)-[4-(propan-2-yl)phenyl]methylidene}propanehydrazide
Smiles: O=C(CCc1c(C)[nH]nc1O)N/N=C/c1ccc(cc1)C(C)C

STL045607
Synonyms: N-[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]morpholine-4-carbimidothioicacid
Smiles: COc1cc(/C=C/C(=O)/N=C(/N2CCOCC2)\S)ccc1OC

STL045609
Synonyms: 5-{[5-(4-chlorophenyl)-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]amino}-5-oxopentanoicacid
Smiles: O=C(Nc1nn2c(=NC(=CC2c2ccccc2)c2ccc(cc2)Cl)[nH]1)CCCC(=O)O

STL045612
Synonyms: 7-benzyl-6-hydroxy-3,4-dihydro-2H,8H-pyrimido[2,1-b][1,3]thiazin-8-one
Smiles: Oc1n2CCCSc2nc(=O)c1Cc1ccccc1

STL045632
Synonyms: 3-{(3E)-2-(2-fluorophenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}benzoicacid
Smiles: OC(=O)c1cccc(c1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccccc1F

STL045646
Synonyms: 2-(4-methoxyphenyl)-4-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole
Smiles: COc1ccc(cc1)C1=CC(n2c(=N1)[nH]c1c2cccc1)c1ccccc1

STL045658
Synonyms: 3-[6-hydroxy-3-methyl-2-oxo-8-(piperidin-1-yl)-2,3-dihydro-7H-purin-7-yl]propanoicacid
Smiles: OC(=O)CCn1c(nc2c1c(O)nc(=O)n2C)N1CCCCC1

STL045668
Synonyms: methyl(2-hydroxy-6-methyl-4-phenylquinolin-3-yl)acetate
Smiles: COC(=O)Cc1c(O)nc2c(c1c1ccccc1)cc(cc2)C

STL045683
Synonyms: 2,6-dihydroxy-5-[(2E)-3-phenylprop-2-en-1-yl]-5-[2-(pyridin-4-yl)ethyl]pyrimidin-4(5H)-one
Smiles: OC1=NC(=O)C(C(=N1)O)(C/C=C/c1ccccc1)CCc1ccncc1

STL045688
Synonyms: 4-[3-(4-bromophenyl)-3-oxo-2-phenylpropyl]morpholin-4-ium
Smiles: Brc1ccc(cc1)C(=O)C(c1ccccc1)C[NH+]1CCOCC1

STL045694
Synonyms: 4-{(4E)-4-[(2-hydroxyphenyl)imino]-3,4-dihydrophthalazin-1-yl}-N,N-dimethylbenzamide
Smiles: CN(C(=O)c1ccc(cc1)c1n[nH]/c(=N/c2ccccc2O)/c2c1cccc2)C

STL045702
Synonyms: (5Z)-5-({[2-(dimethylamino)ethyl]amino}methylidene)-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: CN(CCN/C=C\1/C(=NC(=NC1=O)O)O)C

STL045711
Synonyms: (E)-[4,5-dioxo-1-(pyridinium-3-ylmethyl)-2-(thiophen-2-yl)pyrrolidin-3-ylidene](4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)Cc1ccc[nH+]c1)/[O-]

STL045717
Synonyms: 4-{(1Z)-1-[2-(pyridinium-3-ylcarbonyl)hydrazinylidene]propyl}phenolate
Smiles: CC/C(=N/NC(=O)c1ccc[nH+]c1)/c1ccc(cc1)[O-]

STL045718
Synonyms: (E)-1-benzofuran-2-yl{1-[2-(diethylammonio)ethyl]-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CC[NH+](CCN1C(c2ccccc2F)/C(=C(/c2cc3c(o2)cccc3)\[O-])/C(=O)C1=O)CC

STL045723
Synonyms: 4-(2,4-dichlorophenyl)-6-hydroxy-2-(propylsulfanyl)-4,5-dihydropyridine-3-carbonitrile
Smiles: CCCSC1=C(C#N)C(CC(=N1)O)c1ccc(cc1Cl)Cl

STL045725
Synonyms: methyl4-{[(1Z)-4-{3-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methylphenyl}phthalazin-1(2H)-ylidene]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)/N=c/1\[nH]nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NC(CO)(C)C)C

STL045756
Synonyms: (4-{(E)-[2-hydroxy-4,6-dioxo-1-(prop-2-en-1-yl)-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}phenoxy)aceticacid
Smiles: C=CCN1C(=NC(=O)/C(=C\c2ccc(cc2)OCC(=O)O)/C1=O)O

STL045763
Synonyms: (3E)-4-(1,3-benzodioxol-5-yl)-1-(5-bromo-2,3-dihydroxy-3H-indol-3-yl)but-3-en-2-one
Smiles: O=C(CC1(O)C(=Nc2c1cc(Br)cc2)O)/C=C/c1ccc2c(c1)OCO2

STL045770
Synonyms: N-[(2E)-5-{2-[(2E)-2-(4-hydroxybenzylidene)hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2(3H)-ylidene]-2-methylbenzamide
Smiles: O=C(Cc1n[nH]/c(=N\C(=O)c2ccccc2C)/s1)N/N=C/c1ccc(cc1)O

STL045776
Synonyms: N-[2-hydroxy-3-(2-hydroxy-4,4-dimethyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl)propyl]-4-nitro-N-phenylbenzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1)CN1C(=NC(C1=O)(C)C)O

STL045790
Synonyms: methyl(2Z)-[(2Z)-4-hydroxy-2-{[(4-methylphenyl)carbonyl]imino}-1,3-thiazol-5(2H)-ylidene]ethanoate
Smiles: COC(=O)/C=C/1\S/C(=N\C(=O)c2ccc(cc2)C)/N=C1O

STL045797
Synonyms: 1-(2-methylphenyl)-3-[(2E)-5-(thiophen-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: O=C(Nc1ccccc1C)/N=c/1\[nH]nc(s1)c1cccs1

STL045815
Synonyms: 3-hydroxy-1-oxo-N-(4-oxo-2-pentylquinazolin-3(4H)-yl)-6,7-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-2-carboxamide
Smiles: CCCCCc1nc2ccccc2c(=O)n1NC(=O)c1c(=O)c2cccc3c2n(c1O)CCC3

STL045852
Synonyms: N-[(2Z)-4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2(3H)-ylidene]-3-methylbenzamide
Smiles: COc1ccc(cc1Br)c1cs/c(=N\C(=O)c2cccc(c2)C)/[nH]1

STL045853
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Smiles: C=CCOc1cccc(c1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL045854
Synonyms: (5Z)-3-benzyl-5-{[1-(3-chloropropyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: ClCCCN1CCc2c1ccc(c2)/C=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O

STL045860
Synonyms: methyl3-{[(2-hydroxy-1-nonyl-4-oxo-1,4-dihydroquinolin-3-yl)carbonyl]amino}thiophene-2-carboxylate
Smiles: CCCCCCCCCn1c(O)c(C(=O)Nc2ccsc2C(=O)OC)c(=O)c2c1cccc2

STL045871
Synonyms: {2-[(E)-(2-{[4-(4-methylbenzyl)piperazin-1-ium-1-yl]acetyl}hydrazinylidene)methyl]phenoxy}acetate
Smiles: [O-]C(=O)COc1ccccc1/C=N/NC(=O)C[NH+]1CCN(CC1)Cc1ccc(cc1)C

STL045880
Synonyms: 4-hydroxy-1-(4-methylphenyl)-7-(pyridin-3-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Smiles: Cc1ccc(cc1)n1c(=O)nc(c2c1NC(=NC2(C(F)(F)F)C(F)(F)F)c1cccnc1)O

STL045884
Synonyms: 4-({(E)-[4-(diethylamino)-2-hydroxyphenyl]methylidene}amino)-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCN(c1ccc(c(c1)O)/C=N/n1c(COc2ccccc2)n[nH]c1=S)CC

STL045888
Synonyms: 2,4-dihydroxy-N'-[(E)-pyridin-2-ylmethylidene]-5,6,7,8-tetrahydroquinoline-3-carbohydrazide
Smiles: O=C(c1c(O)nc2c(c1O)CCCC2)N/N=C/c1ccccn1

STL045900
Synonyms: (1E)-1-[(3-chloro-4-methylphenyl)imino]-2-ethyl-3-methyl-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(/c/1=N/c1ccc(c(c1)Cl)C)c1ccccc1[nH]2

STL045903
Synonyms: 5-ammonio-1H-1,2,4-triazole-3-carboxylate
Smiles: [O-]C(=O)c1n[nH]c(n1)[NH3+]

STL045910
Synonyms: (5E)-5-(furan-2-ylmethylidene)-1-(2-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/c1ccco1)c1ccccc1C

STL045913
Synonyms: (5Z)-1-(2-fluorophenyl)-2-sulfanyl-5-(3,4,5-trimethoxybenzylidene)pyrimidine-4,6(1H,5H)-dione
Smiles: COc1c(OC)cc(cc1OC)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1F)S

STL045917
Synonyms: N-[(2Z)-4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2(3H)-ylidene]-3-propoxybenzamide
Smiles: CCCOc1cccc(c1)C(=O)/N=c/1\scc([nH]1)c1ccc(c(c1)Br)OC

STL045921
Synonyms: 6-hydroxy-8-[(3-methoxypropyl)amino]-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: COCCCNc1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C

STL045922
Synonyms: (5E)-5-{[(5-chloro-2-phenoxyphenyl)amino]methylidene}-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C/Nc2cc(Cl)ccc2Oc2ccccc2)/C(=N1)O

STL045928
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(3-phenoxyphenyl)pyrrolidin-3-ylidene}(4-methoxy-3-methylphenyl)methanolate
Smiles: COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)CC[NH+](C)C)/[O-]

STL045930
Synonyms: 1-(1,3-benzodioxol-5-yl)-2-(4-bromophenyl)-2-hydroxy-1,2,3,5,6,7,8,9-octahydroimidazo[1,2-a]azepin-4-ium
Smiles: Brc1ccc(cc1)C1(O)C[N+]2=C(N1c1ccc3c(c1)OCO3)CCCCC2

STL045932
Synonyms: N-[(E)-2-(2-chlorophenyl)-1-(5-sulfanyl-4H-1,2,4-triazol-3-yl)ethenyl]-4-methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)N/C(=C/c1ccccc1Cl)/c1nnc([nH]1)S

STL045938
Synonyms: N-{(E)-amino[(2E)-1,3-benzoxazol-2(3H)-ylideneamino]methylidene}-2-[(phenylcarbonyl)amino]benzamide
Smiles: N/C(=N\C(=O)c1ccccc1NC(=O)c1ccccc1)/N=c\1/oc2c([nH]1)cccc2

STL045942
Synonyms: N-[(2E)-6-ethoxy-4-methylquinazolin-2(1H)-ylidene]-4-methyl-6-(trifluoromethyl)pyrimidin-2-amine
Smiles: CCOc1ccc2c(c1)c(C)n/c(=N/c1nc(C)cc(n1)C(F)(F)F)/[nH]2

STL045945
Synonyms: 4-{[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]amino}-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cn1cccc1/C=N/n1c(=S)[nH]nc1c1ccncc1

STL045959
Synonyms: 5-[(3-chloro-4-methoxybenzyl)sulfanyl]-1H-1,2,4-triazole
Smiles: COc1ccc(cc1Cl)CSc1ncn[nH]1

STL045968
Synonyms: 2-[(7-oxo-7,11-dihydro-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclohexan]-9-yl)sulfanyl]acetamide
Smiles: NC(=O)CSc1n[nH]c2n1c(=O)c1c(n2)c2ccccc2CC21CCCCC2

STL045970
Synonyms: 4-{(E)-[2-({4-[(4-methylphenyl)sulfonyl]piperazin-1-ium-1-yl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: O=C(C[NH+]1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)N/N=C/c1ccc(cc1)C(=O)[O-]

STL045971
Synonyms: 6-{[(4-chlorophenyl)sulfanyl]methyl}-2-{[(2Z)-6-methoxy-4-methylquinazolin-2(3H)-ylidene]amino}pyrimidin-4(1H)-one
Smiles: COc1ccc2c(c1)c(C)[nH]/c(=N/c1nc(=O)cc([nH]1)CSc1ccc(cc1)Cl)/n2

STL045972
Synonyms: furan-2-yl(1H-imidazol-2-yl)methanone
Smiles: O=C(c1ncc[nH]1)c1ccco1

STL045977
Synonyms: 7-hexyl-6-hydroxy-3-methyl-8-(4-methylpiperidin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCCn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)C

STL045978
Synonyms: N-[(4-fluorophenyl)carbonyl]morpholine-4-carbimidothioicacid
Smiles: O=C(c1ccc(cc1)F)/N=C(/N1CCOCC1)\S

STL045987
Synonyms: N-butyl-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]butanamide
Smiles: CCCCN(C(=O)CCC)Cc1cc2ccc(cc2[nH]c1=O)C

STL045988
Synonyms: 2-[(E)-{2-[(4-benzylpiperazin-1-ium-1-yl)acetyl]hydrazinylidene}methyl]-6-(prop-2-en-1-yl)phenolate
Smiles: C=CCc1cccc(c1[O-])/C=N/NC(=O)C[NH+]1CCN(CC1)Cc1ccccc1

STL045999
Synonyms: (5E)-6-hydroxy-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-2-sulfanylpyrimidin-4(5H)-one
Smiles: SC1=NC(=O)/C(=C/NCCc2c[nH]c3c2cccc3)/C(=N1)O

STL046009
Synonyms: 1-cyclopentyl-4-(4-fluorophenyl)-7-hydroxy-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: Fc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C1CCCC1)O

STL046029
Synonyms: N-[1-(3,5-dimethoxybenzyl)-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(OC)cc(c1)CN1C2=C(C(C1=O)(NC(=O)c1cc(OC)c(c(c1)OC)OC)C(F)(F)F)C(=O)CC(C2)(C)C

STL046032
Synonyms: (E)-(4-chlorophenyl)[2-(2-fluorophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)Cc1ccc[nH+]c1)/[O-]

STL046037
Synonyms: N,N-dibenzyl-2-hydroxy-3-(2-hydroxy-4,4-dimethyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl)propan-1-aminium
Smiles: OC(CN1C(=NC(C1=O)(C)C)O)C[NH+](Cc1ccccc1)Cc1ccccc1

STL046043
Synonyms: 6-hydroxy-3-methyl-7-(3-methylbutyl)-8-thioxo-3,7,8,9-tetrahydro-2H-purin-2-one
Smiles: CC(CCn1c(=S)[nH]c2c1c(O)nc(=O)n2C)C

STL046063
Synonyms: (4Z)-4-[(4-fluorophenyl)imino]-6-({[5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Fc1ccc(cc1)/N=c/1\nc(N)nc([nH]1)CSc1nnc(o1)c1ccncc1

STL046068
Synonyms: N-[4-({(Z)-[4-hydroxy-1-(2-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}amino)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N/C=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O

STL046073
Synonyms: 5-(4-chlorophenyl)-4-{[(E)-pyridin-2-ylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccn1

STL046085
Synonyms: 2-{[(2Z)-6-ethyl-4-methylquinazolin-2(3H)-ylidene]amino}-6-(methoxymethyl)pyrimidin-4(1H)-one
Smiles: COCc1cc(=O)nc([nH]1)/N=c/1\nc2ccc(cc2c([nH]1)C)CC

STL046086
Synonyms: (4E)-4-[(2E)-(2-propoxybenzylidene)hydrazinylidene]-3,4-dihydropyrimidin-2(1H)-one
Smiles: CCCOc1ccccc1/C=N/N=c/1\cc[nH]c(=O)[nH]1

STL046089
Synonyms: (3E)-3-[(2-aminophenyl)imino]-5-(3,4-dimethoxyphenyl)cyclohex-1-en-1-ol
Smiles: COc1cc(ccc1OC)C1CC(=C/C(=N/c2ccccc2N)/C1)O

STL046090
Synonyms: 5-benzyl-6-hydroxy-1-(2-methylphenyl)-2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}pyrimidin-4(1H)-one
Smiles: O=C(N1CCOCC1)CSc1nc(=O)c(c(n1c1ccccc1C)O)Cc1ccccc1

STL046094
Synonyms: (4E)-4-[(2E)-(2,4-dimethoxybenzylidene)hydrazinylidene]-3,4-dihydropyrimidin-2(1H)-one
Smiles: COc1cc(OC)ccc1/C=N/N=c/1\cc[nH]c(=O)[nH]1

STL046111
Synonyms: 2-(azepan-1-yl)-7-benzyl-7H-purin-6-ol
Smiles: Oc1nc(nc2c1n(cn2)Cc1ccccc1)N1CCCCCC1

STL046116
Synonyms: 6-ethyl-6-methyl-9-(propylsulfanyl)-6,11-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one
Smiles: CCCSc1n[nH]c2n1c(=O)c1c(n2)c2ccccc2CC1(C)CC

STL046123
Synonyms: N-[(2E)-4,6-dimethylquinazolin-2(1H)-ylidene]-5-(2-phenylethyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: Cc1ccc2c(c1)c(C)n/c(=N/C1=NCN(CN1)CCc1ccccc1)/[nH]2

STL046130
Synonyms: methyl[(2Z)-5-(propylsulfanyl)-1,3-dihydro-2H-benzimidazol-2-ylidene]carbamate
Smiles: CCCSc1ccc2c(c1)[nH]/c(=N\C(=O)OC)/[nH]2

STL046140
Synonyms: (E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}[5-(methoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Smiles: COC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CCC[NH+](C)C)/[O-])C

STL046142
Synonyms: N-cycloheptyl-2,4-dihydroxy-5,6,7,8-tetrahydroquinoline-3-carboxamide
Smiles: O=C(c1c(O)nc2c(c1O)CCCC2)NC1CCCCCC1

STL046154
Synonyms: 1-(3,5-dichlorophenyl)-3-[(4-hydroxy-5-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]pyrrolidine-2,5-dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)CC(C1=O)Sc1nc(O)c(c(=O)[nH]1)C

STL046158
Synonyms: 1-(4-chlorophenyl)-3-[(2Z)-5-(1-phenoxyethyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: Clc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)C(Oc1ccccc1)C

STL046159
Synonyms: 4-phenyl-2,3-dihydro-1,5-benzothiazepin-5-ium-2-carboxylate
Smiles: [O-]C(=O)C1Sc2ccccc2[NH+]=C(C1)c1ccccc1

STL046168
Synonyms: 1-(3,4-dimethylphenyl)-3-[(2E)-5-(phenoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: O=C(/N=c/1\[nH]nc(s1)COc1ccccc1)Nc1ccc(c(c1)C)C

STL046172
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])CCCn1c[nH+]cc1)/[O-]

STL046173
Synonyms: 3-{[(2,4-dimethylphenyl)amino]methyl}-7-methylquinolin-2(1H)-one
Smiles: Cc1ccc(c(c1)C)NCc1cc2ccc(cc2[nH]c1=O)C

STL046178
Synonyms: (3Z)-3-{2-[(3-methoxyphenyl)amino]-4-oxo-1,3-thiazol-5(4H)-ylidene}-1-methyl-1,3-dihydro-2H-indol-2-one
Smiles: COc1cccc(c1)NC1=NC(=O)/C(=C/2\c3ccccc3N(C2=O)C)/S1

STL046180
Synonyms: (2Z)-6-chloro-2-{(2E)-[(5-chlorofuran-2-yl)methylidene]hydrazinylidene}-4-phenyl-2,3-dihydroquinazoline
Smiles: Clc1ccc(o1)/C=N/N=c/1\nc2ccc(cc2c([nH]1)c1ccccc1)Cl

STL046181
Synonyms: (3E)-3-[(2Z)-[1,2,4]triazolo[3,4-a]phthalazin-6(5H)-ylidenehydrazinylidene]-1,3-dihydro-2H-indol-2-one
Smiles: O=C1Nc2c(/C/1=N\N=c\1/[nH]n3cnnc3c3c1cccc3)cccc2

STL046183
Synonyms: 4-[(E)-(2-{[4-(4-methylbenzyl)piperazin-1-ium-1-yl]acetyl}hydrazinylidene)methyl]benzoate
Smiles: O=C(C[NH+]1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1ccc(cc1)C(=O)[O-]

STL046207
Synonyms: (2Z)-2-(1H-benzimidazol-2-yl)-3-hydroxy-4-({[(E)-(4-methoxyphenyl)methylidene]amino}oxy)but-2-enenitrile
Smiles: COc1ccc(cc1)/C=N/OC/C(=C(/c1nc2c([nH]1)cccc2)\C#N)/O

STL046210
Synonyms: 4-amino-6-propyl-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2-thione
Smiles: CCCC1OCc2c(C1)c1c(N)nc(=S)[nH]c1s2

STL046215
Synonyms: 1-[(2Z)-5-(2-ethoxyethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-fluorophenyl)urea
Smiles: CCOCCc1n[nH]/c(=N/C(=O)Nc2ccc(cc2)F)/s1

STL046230
Synonyms: N-[2-hydroxy-3-(2-hydroxy-4,4-dimethyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl)propyl]-4-methyl-N-(2-nitrophenyl)benzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccc(cc1)C)c1ccccc1[N+](=O)[O-])CN1C(=NC(C1=O)(C)C)O

STL046232
Synonyms: 11-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-3,3-dimethyl-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-1-ol
Smiles: OC1=C2C(=Nc3c(NC2c2c(C)nn(c2Cl)c2ccccc2)cccc3)CC(C1)(C)C

STL046239
Synonyms: (E)-(3-methoxyphenyl)[2-(2-methoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1OC)Cc1ccc[nH+]c1)/[O-]

STL046246
Synonyms: 4-[1-(4-hydroxybenzyl)-1H-3,1-benzimidazol-3-ium-2-yl]phenolate
Smiles: [O-]c1ccc(cc1)c1[nH+]c2c(n1Cc1ccc(cc1)O)cccc2

STL046255
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl[2-(4-methylphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: Cc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL046261
Synonyms: N-{2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)-2-[(2E)-2-(pyridin-2-ylmethylidene)hydrazinyl]ethyl}benzamide
Smiles: O=C(c1ccccc1)NC(c1n[nH]c(=O)c2c1cccc2)C(=O)N/N=C/c1ccccn1

STL046268
Synonyms: N-(3-methoxyphenyl)-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]acetamide
Smiles: COc1cccc(c1)N(C(=O)C)Cc1cc2ccc(cc2[nH]c1=O)C

STL046274
Synonyms: (E)-{2-(3-bromophenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Smiles: CCOC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Br)CCC[NH+](C)C)/[O-])C

STL046281
Synonyms: 2-{(4Z)-4-[(3,5-dichlorophenyl)imino]-3,4-dihydroquinazolin-2-yl}phenol
Smiles: Clc1cc(Cl)cc(c1)/N=c/1\[nH]c(nc2c1cccc2)c1ccccc1O

STL046294
Synonyms: 1-[4-fluoro-3-(pyrrolidin-1-yl)phenyl]-1H-tetrazole-5-thiol
Smiles: Fc1ccc(cc1N1CCCC1)n1nnnc1S

STL046308
Synonyms: [(5Z)-4-oxo-5-(pyridinium-3-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl](phenyl)acetate
Smiles: S=C1S/C(=C\c2ccc[nH+]c2)/C(=O)N1C(c1ccccc1)C(=O)[O-]

STL046312
Synonyms: N-(4-ethoxyphenyl)-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]tetrahydrofuran-2-carboxamide
Smiles: CCOc1ccc(cc1)N(C(=O)C1CCCO1)Cc1cc2cc(OC)ccc2[nH]c1=O

STL046321
Synonyms: 6-{[4-(4-phenylquinazolin-2-yl)piperazin-4-ium-1-yl]carbonyl}cyclohex-3-ene-1-carboxylate
Smiles: [O-]C(=O)C1CC=CCC1C(=O)N1CC[NH+](CC1)c1nc2ccccc2c(n1)c1ccccc1

STL046325
Synonyms: (5E)-5-[({4-[ethyl(2-hydroxyethyl)amino]phenyl}amino)methylidene]-6-hydroxy-2-sulfanylpyrimidin-4(5H)-one
Smiles: OCCN(c1ccc(cc1)N/C=C/1\C(=NC(=NC1=O)S)O)CC

STL046326
Synonyms: 4-chloro-2-{[(1-propyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate
Smiles: CCCn1c(NCc2cc(Cl)ccc2[O-])[nH+]c2c1cccc2

STL046339
Synonyms: 4-methoxy-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-phenylbenzamide
Smiles: COc1ccc(cc1)C(=O)N(c1ccccc1)Cc1cc2cccc(c2[nH]c1=O)C

STL046341
Synonyms: 2,2'-(dihydropyrimidinediium-1,3(2H,4H)-diyldimethanediyl)diphenolate
Smiles: [O-]c1ccccc1C[NH+]1CCC[NH+](C1)Cc1ccccc1[O-]

STL046344
Synonyms: (E)-[4-(dimethylsulfamoyl)phenyl]{2-(5-methylfuran-2-yl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: Cc1ccc(o1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)S(=O)(=O)N(C)C)/[O-]

STL046348
Synonyms: 2-[(4,5-dimethyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CSc1nc(C)c(c(=O)[nH]1)C

STL046358
Synonyms: 4-{(3E)-2-(2-fluorophenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}benzenesulfonamide
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccccc1F)c1ccc(cc1)S(=O)(=O)N)/c1ccccc1

STL046362
Synonyms: 3-(ethoxycarbonyl)-1,2-dimethyl-4-[(4-methylpiperazin-1-ium-1-yl)methyl]-1H-indol-5-olate
Smiles: CCOC(=O)c1c(C)n(c2c1c(C[NH+]1CCN(CC1)C)c([O-])cc2)C

STL046366
Synonyms: 4-(5-{(E)-[(4-hydroxy-2-oxo-1,2-dihydropyrimidin-5-yl)imino]methyl}furan-2-yl)benzoicacid
Smiles: Oc1nc(=O)[nH]cc1/N=C/c1ccc(o1)c1ccc(cc1)C(=O)O

STL046367
Synonyms: (E)-{1-(3-carboxypropyl)-2-[4-(dimethylammonio)phenyl]-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Smiles: OC(=O)CCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/[O-])/C1c1ccc(cc1)[NH+](C)C

STL046377
Synonyms: 4-{[(2-fluorophenyl)carbonyl]oxy}-1-methylpiperidinium
Smiles: C[NH+]1CCC(CC1)OC(=O)c1ccccc1F

STL046387
Synonyms: (5E)-5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-1-(4-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)N1C(=NC(=O)/C(=C\Nc2c(=O)n(n(c2C)C)c2ccccc2)/C1=O)S

STL046391
Synonyms: (E)-(4-chlorophenyl){1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}methanolate
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CCCn1cc[nH+]c1)/[O-]

STL046397
Synonyms: (5Z)-3-(4-chlorophenyl)-6-hydroxy-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C/NCCN2CCOCC2)/C1=O)O

STL046399
Synonyms: 1-{3-[4-(diethylamino)phenyl]-11-(furan-2-yl)-1-hydroxy-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}ethanone
Smiles: CCN(c1ccc(cc1)C1CC(=C2C(=Nc3ccccc3N(C2c2ccco2)C(=O)C)C1)O)CC

STL046400
Synonyms: 4-[({[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: O=C(Nc1ccc(cc1)C(=O)[O-])CSc1[nH+]nc(n1c1ccc(cc1)C)c1ccc(cc1)Cl

STL046403
Synonyms: 8,8'-(ethane-1,2-diyldisulfanediyl)bis{7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one}
Smiles: OC(Cn1c(SCCSc2nc3c(n2CC(COc2ccc(cc2)Cl)O)c(O)nc(=O)n3C)nc2c1c(O)nc(=O)n2C)COc1ccc(cc1)Cl

STL046413
Synonyms: (E)-1-benzofuran-2-yl{1-[3-(diethylammonio)propyl]-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CC[NH+](CCCN1C(c2ccccc2F)/C(=C(/c2cc3c(o2)cccc3)\[O-])/C(=O)C1=O)CC

STL046421
Synonyms: N-[(2E)-4,6-dimethylpyrimidin-2(1H)-ylidene]-4-(4-methoxyphenyl)piperazine-1-carboximidamide
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=N)/N=c\1/nc(C)cc([nH]1)C

STL046445
Synonyms: (5E)-1-[2-(4-fluorophenyl)ethyl]-2-hydroxy-5-[(5-methylthiophen-2-yl)methylidene]pyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)CCN1C(=NC(=O)/C(=C\c2ccc(s2)C)/C1=O)O

STL046448
Synonyms: 5-(phenoxymethyl)-4-{[(E)-(3-phenoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1/N=C/c1cccc(c1)Oc1ccccc1)COc1ccccc1

STL046452
Synonyms: (6E)-N~2~-(4-methoxyphenyl)-6-[(4-methoxyphenyl)imino]-N~4~-[2-(morpholin-4-yl)ethyl]-1,6-dihydro-1,3,5-triazine-2,4-diamine
Smiles: COc1ccc(cc1)Nc1nc(NCCN2CCOCC2)n/c(=N/c2ccc(cc2)OC)/[nH]1

STL046458
Synonyms: 1-{[(1-propyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}naphthalen-2-olate
Smiles: CCCn1c(NCc2c([O-])ccc3c2cccc3)[nH+]c2c1cccc2

STL046462
Synonyms: (5Z)-5-({[2-(diethylamino)ethyl]amino}methylidene)-6-hydroxy-3-(2,4,6-trimethylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CCN(CCN/C=C\1/C(=NC(=O)N(C1=O)c1c(C)cc(cc1C)C)O)CC

STL046489
Synonyms: (E)-{2-(3-chlorophenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methanolate
Smiles: Clc1cccc(c1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1c(C)nc2n1cccc2C)/[O-]

STL046497
Synonyms: N-[1-(2,3-dimethoxybenzyl)-2-hydroxy-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]furan-2-carboxamide
Smiles: COc1c(cccc1OC)CN1C(=NC(C1=O)(NC(=O)c1ccco1)C(F)(F)F)O

STL046504
Synonyms: 8-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-7-[2-hydroxy-3-(2,4,6-tribromophenoxy)propyl]-3-methyl-2-oxo-3,7-dihydro-2H-purin-6-olate
Smiles: OCC[NH+]1CCN(CC1)c1nc2c(n1CC(COc1c(Br)cc(cc1Br)Br)O)c([O-])nc(=O)n2C

STL046516
Synonyms: (5E)-1-(4-bromophenyl)-5-(2,4-dihydroxybenzylidene)-2-hydroxypyrimidine-4,6(1H,5H)-dione
Smiles: Brc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(cc2O)O)/C1=O)O

STL046518
Synonyms: ethylN-({5-[(4E)-4-{[4-(2-amino-2-oxoethoxy)phenyl]imino}-3,4-dihydrophthalazin-1-yl]-2-methylphenyl}sulfonyl)glycinate
Smiles: CCOC(=O)CNS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N/c2ccc(cc2)OCC(=O)N)/c2c1cccc2

STL046521
Synonyms: 1-{3-[4-(diphenylmethyl)piperazin-1-ium-1-yl]propyl}-1H-benzimidazol-2-olate
Smiles: [O-]c1nc2c(n1CCC[NH+]1CCN(CC1)C(c1ccccc1)c1ccccc1)cccc2

STL046535
Synonyms: 2-(4-{[(1E)-4-{3-[(2-hydroxyethyl)sulfamoyl]-4-methylphenyl}phthalazin-1(2H)-ylidene]amino}phenoxy)acetamide
Smiles: OCCNS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N/c2ccc(cc2)OCC(=O)N)/c2c1cccc2

STL046538
Synonyms: 4-[(E)-{2-[(1H-3,1-benzimidazol-3-ium-2-ylsulfanyl)acetyl]hydrazinylidene}methyl]-2-ethoxyphenolate
Smiles: CCOc1cc(/C=N/NC(=O)CSc2[nH]c3c([nH+]2)cccc3)ccc1[O-]

STL046543
Synonyms: 4-{[(E)-{1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene}methyl]amino}benzoicacid
Smiles: COc1ccc(cc1OC)CCN1C(=O)N=C(/C(=C\Nc2ccc(cc2)C(=O)O)/C1=O)O

STL046550
Synonyms: (E)-[4,5-dioxo-2-phenyl-1-(pyrimidin-1-ium-2-yl)pyrrolidin-3-ylidene](phenyl)methanolate
Smiles: [O-]/C(=C\1/C(=O)C(=O)N(C1c1ccccc1)c1nccc[nH+]1)/c1ccccc1

STL046551
Synonyms: 2-[(dimethylammonio)methyl]-4-methyl-6-oxo-6H-benzo[c]chromen-3-olate
Smiles: C[NH+](Cc1cc2c(c(c1[O-])C)oc(=O)c1c2cccc1)C

STL046558
Synonyms: (4E)-4-[(2E)-(pyridin-2-ylmethylidene)hydrazinylidene]-3,4-dihydropyrimidin-2(1H)-one
Smiles: O=c1[nH]cc/c(=N\N=C\c2ccccn2)/[nH]1

STL046561
Synonyms: N-(2,5-dimethylphenyl)-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]furan-2-carboxamide
Smiles: Cc1ccc(c(c1)N(C(=O)c1ccco1)Cc1cc2cc(C)ccc2[nH]c1=O)C

STL046562
Synonyms: 1-[(2E)-4-methyl-6-(trifluoromethyl)pyrimidin-2(1H)-ylidene]-3-(4-phenoxyphenyl)guanidine
Smiles: N=C(/N=c\1/nc(C)cc([nH]1)C(F)(F)F)Nc1ccc(cc1)Oc1ccccc1

STL046589
Synonyms: 4-methyl-6-oxo-2-(pyrrolidinium-1-ylmethyl)-6H-benzo[c]chromen-3-olate
Smiles: [O-]c1c(C[NH+]2CCCC2)cc2c(c1C)oc(=O)c1c2cccc1

STL046602
Synonyms: 4-{[(E)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]amino}benzoicacid
Smiles: SC1=NC(=O)/C(=C/Nc2ccc(cc2)C(=O)O)/C(=N1)O

STL046608
Synonyms: (E)-{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(pyridin-4-yl)methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccncc2)/[O-])/C(N1CCC[NH+]1CCOCC1)c1ccccc1

STL046626
Synonyms: (5Z)-6-hydroxy-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)-3-(2-phenylethyl)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/NCCCn2cncc2)/C(=O)N1CCc1ccccc1

STL046628
Synonyms: (5Z)-3-(2-chlorophenyl)-6-hydroxy-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/NCCN2CCOCC2)/C(=O)N1c1ccccc1Cl

STL046629
Synonyms: 2-methoxy-4-[(E)-(2-{[(1-methyl-1H-3,1-benzimidazol-3-ium-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenolate
Smiles: COc1cc(/C=N/NC(=O)CSc2[nH+]c3c(n2C)cccc3)ccc1[O-]

STL046631
Synonyms: N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-4-methylpyrimidin-2-amine
Smiles: Cc1ccnc(n1)/N=c\1/sc2c([nH]1)cccc2

STL046651
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-3-ylidene}(4-methoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)OC)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL046652
Synonyms: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-6-hydroxy-3-(2-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C/c2nc3c([nH]2)cccc3)/C1=O)O

STL046660
Synonyms: 3-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(4-ethoxyphenyl)-4,5-dioxopyrrolidin-1-yl]propanoicacid
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CCC(=O)O

STL046663
Synonyms: (E)-[4,5-dioxo-2-phenyl-1-(pyrimidin-1-ium-2-yl)pyrrolidin-3-ylidene](4-methoxyphenyl)methanolate
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)c1nccc[nH+]1)/[O-]

STL046673
Synonyms: 6-methyl-4-phenyl-3-(piperidin-1-yl)-3,4-dihydroquinolin-2-ol
Smiles: Cc1ccc2c(c1)C(c1ccccc1)C(C(=N2)O)N1CCCCC1

STL046685
Synonyms: 4-(methylsulfanyl)-2-[(5Z)-4-oxo-5-(pyridinium-4-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]butanoate
Smiles: CSCCC(N1C(=S)S/C(=C\c2cc[nH+]cc2)/C1=O)C(=O)[O-]

STL046704
Synonyms: ethylN-{[5-(4-hydroxyphthalazin-1-yl)-2-methylphenyl]sulfonyl}glycinate
Smiles: CCOC(=O)CNS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)O

STL046709
Synonyms: 2-{[3-cyano-6-hydroxy-4-(2-methoxyphenyl)-4,5-dihydropyridin-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)N=C(CC1c1ccccc1OC)O

STL046713
Synonyms: (E)-{2-(4-chlorophenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Smiles: C[NH+](CCN1C(c2ccc(cc2)Cl)/C(=C(/c2cnn(c2C)c2ccccc2)\[O-])/C(=O)C1=O)C

STL046718
Synonyms: 4-(benzo[cd]indolium-2-ylamino)benzoate
Smiles: [O-]C(=O)c1ccc(cc1)NC1=[NH+]c2c3c1cccc3ccc2

STL046720
Synonyms: 5-(4-fluorophenyl)-7-(furan-2-yl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Fc1ccc(cc1)C1=CC(c2ccco2)n2c(=N1)[nH]cn2

STL046747
Synonyms: (E)-[2-(2,5-dimethoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](4-fluorophenyl)methanolate
Smiles: COc1ccc(c(c1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1)OC

STL046752
Synonyms: (2E,5Z)-2-[(4-hydroxyphenyl)imino]-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-2,5-dihydro-1,3-thiazol-4-ol
Smiles: C/C(=C\c1ccccc1)/C=C/1\S/C(=N/c2ccc(cc2)O)/N=C1O

STL046764
Synonyms: 6-methyl-3-(morpholin-4-ylmethyl)-4-phenylquinolin-2-ol
Smiles: Cc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)CN1CCOCC1

STL046766
Synonyms: 3-[(E)-2-ethoxy-2-hydroxyethenyl]-2H-1,4-benzoxazin-2-one
Smiles: CCO/C(=C/c1nc2ccccc2oc1=O)/O

STL046771
Synonyms: 2-tert-butyl-1,2,4-triazaspiro[4.5]dec-3-ene-3-thiol
Smiles: CC(N1NC2(N=C1S)CCCCC2)(C)C

STL046778
Synonyms: 1-heptyl-2-hydroxy-4-oxo-N'-[(E)-pyridin-4-ylmethylidene]-1,4-dihydroquinoline-3-carbohydrazide
Smiles: CCCCCCCn1c(O)c(C(=O)N/N=C/c2ccncc2)c(=O)c2c1cccc2

STL046780
Synonyms: 2-fluoro-N-[3-(4-methyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)phenyl]benzamide
Smiles: O=C(c1ccccc1F)Nc1cccc(c1)c1nnc(n1C)S

STL046782
Synonyms: (5E)-3-benzyl-5-({[4-(diethylamino)phenyl]amino}methylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCN(c1ccc(cc1)N/C=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O)CC

STL046788
Synonyms: 3-[(Z)-2-(2,4-dimethyl-1,3-oxazol-5-yl)-2-hydroxyethenyl]-7-nitro-2H-1,4-benzoxazin-2-one
Smiles: Cc1nc(c(o1)/C(=C/c1nc2ccc(cc2oc1=O)[N+](=O)[O-])/O)C

STL046790
Synonyms: 2,4-dihydroxy-N-(2-methoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carboxamide
Smiles: COc1ccccc1NC(=O)c1c(O)nc2c(c1O)CCCC2

STL046798
Synonyms: (E)-[4,5-dioxo-1-(pyridinium-3-ylmethyl)-2-(pyridin-3-yl)pyrrolidin-3-ylidene][2-methyl-4-(propan-2-yloxy)phenyl]methanolate
Smiles: CC(Oc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)Cc1ccc[nH+]c1)/[O-])C

STL046804
Synonyms: 6-hydroxy-3-methyl-8-[(2-methylprop-2-en-1-yl)sulfanyl]-7-(3-phenylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(=C)CSc1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C

STL046818
Synonyms: N-{2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl}benzamide
Smiles: O=C(c1ccccc1)NC(c1n[nH]c(=O)c2c1cccc2)C(=O)N/N=C/c1cccnc1

STL046823
Synonyms: N'-(4,6-dihydroxy-5-nitropyrimidin-2-yl)pyridine-2-carbohydrazide
Smiles: O=C(c1ccccn1)NNc1nc(O)c(c(n1)O)[N+](=O)[O-]

STL046833
Synonyms: 5-benzyl-6-hydroxy-2-[(2-oxo-2-phenylethyl)sulfanyl]-1-phenylpyrimidin-4(1H)-one
Smiles: O=C(c1ccccc1)CSc1nc(=O)c(c(n1c1ccccc1)O)Cc1ccccc1

STL046840
Synonyms: (E)-{2-(4-chlorophenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate
Smiles: Clc1ccc(cc1)C1N(CCCn2c[nH+]cc2)C(=O)C(=O)/C/1=C(\c1sc(nc1C)C)/[O-]

STL046847
Synonyms: 7-methyl-3-{[(3-methylphenyl)amino]methyl}quinolin-2(1H)-one
Smiles: Cc1cccc(c1)NCc1cc2ccc(cc2[nH]c1=O)C

STL046848
Synonyms: 6-methyl-2-sulfanylthieno[2,3-d]pyrimidin-4-ol
Smiles: Sc1nc(O)c2c(n1)sc(c2)C

STL046854
Synonyms: 7-hydroxy-4-(4-methoxyphenyl)-1-(pentan-2-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: CCCC(n1[nH]c(=O)c2c1N=C(O)CSC2c1ccc(cc1)OC)C

STL046865
Synonyms: (E)-furan-2-yl{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccco2)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STL046866
Synonyms: ethyl4-({(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-4,5-dihydro-1H-pyrazol-4-yl]ethylidene}amino)benzoate
Smiles: CCCC1=NN(C(=O)C1/C(=N/c1ccc(cc1)C(=O)OCC)/C)c1nc2c(s1)cccc2

STL046869
Synonyms: (4E)-3-nitro-4-(phenylimino)-4H-chromen-2-ol
Smiles: [O-][N+](=O)c1c(O)oc2c(/c/1=N\c1ccccc1)cccc2

STL046884
Synonyms: methyl(2Z)-[(2Z)-2-[(2E)-benzylidenehydrazinylidene]-4-hydroxy-1,3-thiazol-5(2H)-ylidene]ethanoate
Smiles: COC(=O)/C=C/1\S/C(=N\N=C\c2ccccc2)/N=C1O

STL046885
Synonyms: 7-bromo-5-(2-chlorophenyl)-2-hydroxy-3H-1,4-benzodiazepin-3-ylpropanoate
Smiles: CCC(=O)OC1N=C(c2c(N=C1O)ccc(c2)Br)c1ccccc1Cl

STL046891
Synonyms: ethyl(2Z)-2-[(3-chlorophenyl)imino]-4-hydroxy-2,5-dihydrofuran-3-carboxylate
Smiles: CCOC(=O)C1=C(O)CO/C/1=N\c1cccc(c1)Cl

STL046894
Synonyms: 3-(1-methyl-1H-benzimidazol-2-yl)-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-2-oxo-2H-chromen-7-olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(=O)c(c2)c1nc2c(n1C)cccc2

STL046899
Synonyms: 5-bromo-2-hydroxy-6'-methyl-2'-phenyl-4H-1,4'-bipyrimidin-4-one
Smiles: Cc1nc(nc(c1)n1cc(Br)c(=O)nc1O)c1ccccc1

STL046902
Synonyms: 5-butyl-2-(4-chlorophenyl)-5-methyl-2,5-dihydro-1H-1,2,4-triazole-3-thiol
Smiles: CCCCC1(C)NN(C(=N1)S)c1ccc(cc1)Cl

STL046907
Synonyms: N-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-6-hydroxy-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Smiles: CCc1n[nH]/c(=N\C(=O)c2c(O)c3cccc4c3n(c2=O)CC4)/s1

STL046924
Synonyms: 6-hydroxy-3-methyl-8-(2-methylpiperidin-1-yl)-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(=C)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCCCC1C

STL046933
Synonyms: 2-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)Cc1c(C)[nH]nc1O)OC

STL046942
Synonyms: 4-hydroxy-N-(2-methyl-4-oxoquinazolin-3(4H)-yl)-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Smiles: Cc1nc2ccccc2c(=O)n1NC(=O)c1c(O)n2CCc3c2c(c1=O)ccc3

STL046944
Synonyms: 1-hexyl-2-hydroxy-4-oxo-N-(pyrazin-2-yl)-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCCCn1c(O)c(C(=O)Nc2cnccn2)c(=O)c2c1cccc2

STL046946
Synonyms: N'-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}pyridine-4-carbohydrazide
Smiles: C=CCN1C(=NC(=O)/C(=C\NNC(=O)c2ccncc2)/C1=O)S

STL046951
Synonyms: N-{2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)-2-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]ethyl}benzamide
Smiles: O=C(c1ccccc1)NC(c1n[nH]c(=O)c2c1cccc2)C(=O)N/N=C/c1ccncc1

STL046958
Synonyms: 7-benzyl-2-(dimethylamino)-7H-purin-6-ol
Smiles: CN(c1nc(O)c2c(n1)ncn2Cc1ccccc1)C

STL046977
Synonyms: 3-(1,3-benzothiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-4-oxo-4H-chromen-7-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])c(CC)cc2c1oc(C(=O)OCC)c(c2=O)c1nc2c(s1)cccc2

STL046988
Synonyms: 6-chloro-3-[4-(3-methoxyphenyl)piperazin-1-yl]-4-phenylquinolin-2-ol
Smiles: COc1cccc(c1)N1CCN(CC1)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STL047009
Synonyms: (E)-{2-(4-methylphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Smiles: Cc1ccc(cc1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cnn(c1C)c1ccccc1)/[O-]

STL047012
Synonyms: 2-hydroxy-4-oxo-1-(prop-2-en-1-yl)-N'-[(E)-pyridin-2-ylmethylidene]-1,4-dihydroquinoline-3-carbohydrazide
Smiles: C=CCn1c(O)c(C(=O)N/N=C/c2ccccn2)c(=O)c2c1cccc2

STL047018
Synonyms: methyl{[3-cyano-4-(2,3-dichlorophenyl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate
Smiles: COC(=O)CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1cccc(c1Cl)Cl

STL047025
Synonyms: ethyl[(5-{[(4-hydroxy-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nnc(n1C)CSc1nc(O)c2c(n1)sc(c2C)C

STL047028
Synonyms: 1-(2-fluorophenyl)-3-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: CCCc1n[nH]/c(=N/C(=O)Nc2ccccc2F)/s1

STL047033
Synonyms: (3Z)-1-benzyl-3-[(4-hydroxyquinazolin-2-yl)methylidene]-1,3-dihydro-2H-indol-2-one
Smiles: O=C1/C(=C\c2nc(O)c3c(n2)cccc3)/c2c(N1Cc1ccccc1)cccc2

STL047054
Synonyms: 1-(3,4-dimethylphenyl)-3-[(2Z)-5-(3-methoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: COc1cccc(c1)c1n[nH]/c(=N/C(=O)Nc2ccc(c(c2)C)C)/s1

STL047067
Synonyms: N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-(2-methoxyphenyl)carbamimidoyl]-1-phenylmethanesulfonamide
Smiles: COc1ccccc1/N=C(/NS(=O)(=O)Cc1ccccc1)\Nc1nc(C)cc(n1)C

STL047073
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CCCn1c[nH+]cc1)/[O-]

STL047085
Synonyms: (E)-[2-(4-ethoxy-3-methoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](phenyl)methanolate
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL047087
Synonyms: N-[(Z)-[(2Z)-1,3-benzothiazol-2(3H)-ylideneamino]{[(4-fluorophenyl)carbonyl]amino}methylidene]-3-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)N/C(=N/C(=O)c1cccc(c1)F)/N=c/1\sc2c([nH]1)cccc2

STL047095
Synonyms: N-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4-hydroxy-1-octyl-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCCCCCn1c(=O)c(C(=O)/N=c/2\[nH]c3c([nH]2)cccc3)c(c2c1cccc2)O

STL047099
Synonyms: methyl3-(4-hydroxy-6-methyl-2-sulfanylpyrimidin-5-yl)propanoate
Smiles: COC(=O)CCc1c(C)nc(nc1O)S

STL047106
Synonyms: N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-phenylpyridine-4-carboxamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)c1ccncc1)c1ccccc1

STL047112
Synonyms: 5-{(4E)-4-[(4-hydroxyphenyl)imino]-3,4-dihydrophthalazin-1-yl}-2-methyl-N-(tetrahydrofuran-2-ylmethyl)benzenesulfonamide
Smiles: Oc1ccc(cc1)/N=c\1/[nH]nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NCC1CCCO1)C

STL047122
Synonyms: ethyl(2Z)-4-(phenylamino)-2-(phenylimino)-1,2-dihydroquinoline-3-carboxylate
Smiles: CCOC(=O)c1/c(=N/c2ccccc2)/[nH]c2c(c1Nc1ccccc1)cccc2

STL047126
Synonyms: (2Z)-2-{[(4-fluorophenyl)carbonyl]imino}-5-methyl-2,3-dihydro-1,3-thiazol-4-yl4-fluorobenzoate
Smiles: Fc1ccc(cc1)C(=O)Oc1[nH]/c(=N/C(=O)c2ccc(cc2)F)/sc1C

STL047131
Synonyms: 5-phenyl-4,6,7,8-tetrahydrocyclopenta[d]pyrazolo[3,4-b]pyridin-1-amine
Smiles: Nc1nnc2c1c1CCCc1c([nH]2)c1ccccc1

STL047139
Synonyms: (E)-(3-methoxyphenyl)[2-(4-nitrophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])Cc1ccc[nH+]c1)/[O-]

STL047140
Synonyms: (5Z)-5-(2,3-dimethoxybenzylidene)-1-(2-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1cccc(c1OC)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1F)S

STL047141
Synonyms: 2-{4-methyl-5-[(E)-2-phenylethenyl]-4H-1,2,4-triazol-2-ium-3-yl}phenolate
Smiles: Cn1c(/C=C/c2ccccc2)n[nH+]c1c1ccccc1[O-]

STL047153
Synonyms: N-(4-methoxyphenyl)-3-nitro-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1ccc(cc1)N(C(=O)c1cccc(c1)[N+](=O)[O-])Cc1cc2ccccc2[nH]c1=O

STL047173
Synonyms: 2-(2,4-dimethylphenyl)-1-[(2E)-6-(methoxymethyl)-4-oxo-3,4-dihydropyrimidin-2(1H)-ylidene]guanidine
Smiles: COCc1cc(=O)[nH]/c(=N/C(=N/c2ccc(cc2C)C)/N)/[nH]1

STL047175
Synonyms: N-[(2E)-5-[(2,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]furan-2-carboxamide
Smiles: Cc1ccc(c(c1)C)OCc1n[nH]/c(=N\C(=O)c2ccco2)/s1

STL047176
Synonyms: (E)-(2,4-dimethyl-1,3-thiazol-5-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}methanolate
Smiles: Cc1nc(c(s1)/C(=C\1/C(c2cccnc2)N(C(=O)C1=O)CC[NH+]1CCOCC1)/[O-])C

STL047181
Synonyms: phthalazine-1,4-diol
Smiles: Oc1nnc(c2c1cccc2)O

STL047193
Synonyms: 5-amino-7-(4-chlorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
Smiles: N#CC1=C(N)N=c2n(C1c1ccc(cc1)Cl)nc[nH]2

STL047199
Synonyms: (E)-[2-(4-chlorophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](thiophen-2-yl)methanolate
Smiles: Clc1ccc(cc1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

STL047200
Synonyms: 5-(1,3-benzodioxol-5-ylmethyl)-6-hydroxy-2-oxo-2,3-dihydropyrimidin-4-olate
Smiles: Oc1nc(=O)[nH]c(c1Cc1ccc2c(c1)OCO2)[O-]

STL047204
Synonyms: 6-chloro-3-[(Z)-2-(4-chlorophenyl)-2-hydroxyethenyl]-2H-1,4-benzoxazin-2-one
Smiles: Clc1ccc(cc1)/C(=C/c1nc2cc(Cl)ccc2oc1=O)/O

STL047210
Synonyms: (5Z)-1-phenyl-2-sulfanyl-5-(2,3,4-trimethoxybenzylidene)pyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccc(c(c1OC)OC)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1)S

STL047213
Synonyms: 3-{[6-hydroxy-3-methyl-2-oxo-7-(prop-2-en-1-yl)-3,7-dihydro-2H-purin-8-yl]sulfanyl}propanoicacid
Smiles: C=CCn1c(SCCC(=O)O)nc2c1c(O)nc(=O)n2C

STL047217
Synonyms: 5,5'-bis(4-chlorophenyl)-2,2'-diphenyltetrahydro-2H,2'H-3,3'-bipyrrolo[3,4-d][1,2]oxazole-4,4',6,6'(3H,3'H,5H,5'H)-tetrone
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)Cl)c1ccccc1)c1ccccc1

STL047229
Synonyms: ethyl6-chloro-1-ethyl-2-hydroxy-4-oxo-1,4-dihydroquinoline-3-carboxylate
Smiles: CCn1c(O)c(C(=O)OCC)c(=O)c2c1ccc(c2)Cl

STL047250
Synonyms: 5-cyclohexyl-4-{[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cc(ccc1O)/C=N/n1c(=S)[nH]nc1C1CCCCC1

STL047259
Synonyms: 7-(4-fluorophenyl)-5-(4-methylphenyl)-3,7-dihydrotetrazolo[1,5-a]pyrimidine
Smiles: Cc1ccc(cc1)C1=CC(n2c(=N1)[nH]nn2)c1ccc(cc1)F

STL047261
Synonyms: 3,4,5-trimethoxy-2-[({[(1-methyl-1H-tetrazol-4-ium-5-yl)sulfanyl]acetyl}amino)methyl]benzoate
Smiles: COc1c(CNC(=O)CSc2[nH+]nnn2C)c(cc(c1OC)OC)C(=O)[O-]

STL047267
Synonyms: 4-(2-bromophenyl)-1-chloro-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinolinium-6-carboxylate
Smiles: ClC1C(Sc2ccccc2[N+](=O)[O-])CC2C1c1cccc(c1[NH2+]C2c1ccccc1Br)C(=O)[O-]

STL047284
Synonyms: 2-hydroxy-1-methyl-4-oxo-N'-[(E)-pyridin-3-ylmethylidene]-1,4-dihydroquinoline-3-carbohydrazide
Smiles: O=C(c1c(=O)c2ccccc2n(c1O)C)N/N=C/c1cccnc1

STL047305
Synonyms: (E)-{2-(3-chlorophenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Smiles: Clc1cccc(c1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cnn(c1C)c1ccccc1)/[O-]

STL047308
Synonyms: N-[2-(2-{(Z)-[1-(4-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-3-yl)ethyl]acetamide
Smiles: CC(=O)NCCc1c(/C=C\2/C(=O)N=C(N(C2=O)c2ccc(cc2)C)S)[nH]c2c1cccc2

STL047310
Synonyms: 5-cyclohexyl-4-{[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2C2CCCCC2)cc(c1O)OC

STL047311
Synonyms: 5-[(4Z)-4-(1,3-benzodioxol-5-ylimino)-3,4-dihydrophthalazin-1-yl]-N,2-dimethylbenzenesulfonamide
Smiles: CNS(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N\c2ccc3c(c2)OCO3)/c2c1cccc2

STL047314
Synonyms: (2Z)-2-(1H-benzimidazol-2-yl)-3-hydroxy-4-(4-methoxyphenoxy)but-2-enenitrile
Smiles: COc1ccc(cc1)OC/C(=C(/c1nc2c([nH]1)cccc2)\C#N)/O

STL047315
Synonyms: 1-(4-ethoxyphenyl)-3-[(5-ethyl-4-hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]pyrrolidine-2,5-dione
Smiles: CCOc1ccc(cc1)N1C(=O)CC(C1=O)Sc1nc(O)c(c(=O)[nH]1)CC

STL047319
Synonyms: [(2Z)-2-{(2E)-[4-(dimethylammonio)benzylidene]hydrazinylidene}-4-hydroxy-2,5-dihydro-1,3-thiazol-5-yl]acetate
Smiles: [O-]C(=O)CC1S/C(=N\N=C\c2ccc(cc2)[NH+](C)C)/N=C1O

STL047335
Synonyms: 2-methoxy-6-{(E)-[(2Z)-[1,2,4]triazolo[3,4-a]phthalazin-6(5H)-ylidenehydrazinylidene]methyl}phenol
Smiles: COc1cccc(c1O)/C=N/N=c/1\[nH]n2cnnc2c2c1cccc2

STL047344
Synonyms: (5Z)-3-hexyl-6-hydroxy-5-{[(4-methylpiperazin-1-yl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: CCCCCCN1C(=O)N=C(/C(=C/NN2CCN(CC2)C)/C1=O)O

STL047349
Synonyms: 1-[11-(2,4-dimethoxyphenyl)-1-hydroxy-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2-methylpropan-1-one
Smiles: COc1ccc(c(c1)OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(C)C)cccc2)(C)C

STL047368
Synonyms: (5E)-4-hydroxy-5-[2-(morpholin-4-yl)-2-oxoethylidene]-1,3-thiazol-2(5H)-one
Smiles: O=C(N1CCOCC1)/C=C\1/SC(=O)N=C1O

STL047370
Synonyms: (2Z)-4-(4-chlorophenyl)-2-[(2Z)-(2,4-dimethoxybenzylidene)hydrazinylidene]-6-(trifluoromethyl)-1,2-dihydropyrimidine
Smiles: COc1cc(OC)ccc1/C=N\N=c\1/nc(cc([nH]1)C(F)(F)F)c1ccc(cc1)Cl

STL047378
Synonyms: 2,4-dihydroxy-5,6,7,8-tetrahydroquinoline-3-carbohydrazide
Smiles: NNC(=O)c1c(O)nc2c(c1O)CCCC2

STL047391
Synonyms: 6-hydroxy-7-(2-methoxyethyl)-3-methyl-8-(4-methylpiperidin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: COCCn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)C

STL047392
Synonyms: 2-{[(4-hydroxy-6-propylpyrimidin-2-yl)sulfanyl]methyl}quinazolin-4-ol
Smiles: CCCc1nc(SCc2nc(O)c3c(n2)cccc3)nc(c1)O

STL047395
Synonyms: 2-methoxy-5-[(E)-{2-[(1-methyl-1H-indolium-3-yl)carbonyl]hydrazinylidene}methyl]phenolate
Smiles: COc1ccc(cc1[O-])/C=N/NC(=O)C1=C[NH+](c2c1cccc2)C

STL047396
Synonyms: (5E)-6-hydroxy-3-(2-methoxyphenyl)-5-[(piperidin-1-ylamino)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C\NN2CCCCC2)/C1=O)O

STL047413
Synonyms: 7-butyl-6-hydroxy-3-methyl-8-[(2-oxopropyl)sulfanyl]-3,7-dihydro-2H-purin-2-one
Smiles: CCCCn1c(SCC(=O)C)nc2c1c(O)nc(=O)n2C

STL047419
Synonyms: (5E)-1-(4-methylphenyl)-5-({[3-(morpholin-4-yl)propyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=NC(=O)/C(=C\NCCCN2CCOCC2)/C1=O)S

STL047436
Synonyms: 2,3-dimethoxy-6-{(E)-[2-({[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: COc1c(OC)ccc(c1C(=O)[O-])/C=N/NC(=O)CSc1[nH+]nc(n1c1ccccc1)c1cc(OC)c(c(c1)OC)OC

STL047441
Synonyms: (3-{(E)-[2-(1,3-benzothiazol-3-ium-2-yl)hydrazinylidene]methyl}phenoxy)acetate
Smiles: [O-]C(=O)COc1cccc(c1)/C=N/Nc1sc2c([nH+]1)cccc2

STL047442
Synonyms: dimethyl5-[({(2E)-4-hydroxy-2-[(4-methylphenyl)imino]-5,6-dihydro-2H-1,3-thiazin-6-yl}carbonyl)amino]benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(NC(=O)C2CC(=N/C(=N\c3ccc(cc3)C)/S2)O)cc(c1)C(=O)OC

STL047445
Synonyms: (E)-{2-(3-chlorophenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)CCCn1c[nH+]cc1)/[O-]

STL047451
Synonyms: 2-[(1H-3,1-benzimidazol-3-ium-2-ylamino)methyl]-4-chlorophenolate
Smiles: Clc1ccc(c(c1)CNc1[nH]c2c([nH+]1)cccc2)[O-]

STL047452
Synonyms: 2-hydroxy-4-oxo-1-propyl-N-(pyrazin-2-yl)-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCn1c(O)c(C(=O)Nc2cnccn2)c(=O)c2c1cccc2

STL047458
Synonyms: N-[(4E)-1,7-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-ylidene]-2,4-dimethylaniline
Smiles: Cc1ccc(c(c1)C)/N=c\1/nc[nH]c2c1cn[nH]2

STL047464
Synonyms: (5E)-5-[(3-methylphenyl)imino]-5H-anthra[1,9-cd][1,2]oxazol-6-ol
Smiles: Cc1cccc(c1)/N=C/1\C=Cc2c3c1c(O)c1ccccc1c3on2

STL047465
Synonyms: N-[1-benzyl-4-hydroxy-2,6-dioxo-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]furan-2-carboxamide
Smiles: O=C1Nc2c(C1(NC(=O)c1ccco1)C(F)(F)F)c(O)nc(=O)n2Cc1ccccc1

STL047480
Synonyms: (6-bromo-2-methyl-4-phenylquinazolin-3-ium-3(4H)-yl)acetate
Smiles: [O-]C(=O)C[NH+]1C(=Nc2c(C1c1ccccc1)cc(cc2)Br)C

STL047484
Synonyms: (E)-1-benzofuran-2-yl{2-(4-chlorophenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: C[NH+](CCN1C(c2ccc(cc2)Cl)/C(=C(/c2cc3c(o2)cccc3)\[O-])/C(=O)C1=O)C

STL047486
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2cccs2)/[O-])/C1c1ccc(cc1)OC)CC

STL047494
Synonyms: N-[2-hydroxy-5-oxo-1-(3-phenylpropyl)-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]-2,3,4-trimethoxybenzamide
Smiles: COc1c(ccc(c1OC)OC)C(=O)NC1(N=C(N(C1=O)CCCc1ccccc1)O)C(F)(F)F