FULL DB

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

STK699847
Synonyms: 2-benzyl-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(Cc2ccccc2)C(=O)C2C1C(C=CC2c1ccccc1)c1ccccc1

STK699848
Synonyms: (2Z)-2-(pentafluorophenyl)-3-phenylprop-2-enoicacid
Smiles: OC(=O)/C(=C\c1ccccc1)/c1c(F)c(F)c(c(c1F)F)F

STK699850
Synonyms: 8-[(3-bromopropyl)sulfanyl]-3-methyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(SCCCBr)nc2c1c(=O)[nH]c(=O)n2C

STK699852
Synonyms: ethyl(8S,8aR)-6-amino-8-(biphenyl-4-yl)-5,7,7-tricyano-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccc(cc1)c1ccccc1)C(C(=C2C#N)N)(C#N)C#N

STK699854
Synonyms: 2-[(2E)-2-benzylidene-1-methylhydrazinyl]-4-(4-phenoxyphenyl)-1,3-thiazole
Smiles: CN(c1scc(n1)c1ccc(cc1)Oc1ccccc1)/N=C/c1ccccc1

STK699855
Synonyms: 2-amino-4-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c(C)nn(c1Cl)c1ccccc1)c(=O)oc1c2cccc1

STK699856
Synonyms: 2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: Nc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK699857
Synonyms: potassium2-(2-amino-6-methylpyrimidin-4-yl)hydrazinecarbodithioate
Smiles: [S-]C(=S)NNc1cc(C)nc(n1)N.[K+]

STK699858
Synonyms: 1-(3-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-cyclohexyl-1-hydroxyurea
Smiles: O=C(N(C1N(/N=C/c2c(F)cccc2Cl)C(=S)SC1(C)C)O)NC1CCCCC1

STK699859
Synonyms: 5,5-dimethyl-4-[(Z)-[(2E)-3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene](oxido)-lambda~5~-azanyl]-3-phenyl-1,3-thiazolidine-2-thione
Smiles: [O-]/[N+](=C\C=C\c1ccc(o1)[N+](=O)[O-])/C1N(C(=S)SC1(C)C)c1ccccc1

STK699860
Synonyms: (2E)-3-[4-(diethylamino)-2,3,5,6-tetrafluorophenyl]prop-2-enoicacid
Smiles: CCN(c1c(F)c(F)c(c(c1F)F)/C=C/C(=O)O)CC

STK699861
Synonyms: 2,2',2''-methanetriyltris[5-(3-nitrophenyl)furan]
Smiles: [O-][N+](=O)c1cccc(c1)c1ccc(o1)C(c1ccc(o1)c1cccc(c1)[N+](=O)[O-])c1ccc(o1)c1cccc(c1)[N+](=O)[O-]

STK699862
Synonyms: 8-(dodecylsulfanyl)-3-methyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1CCCCC)c(=O)[nH]c(=O)n2C

STK699863
Synonyms: 5,5-dimethyl-3-(prop-2-en-1-yl)-2-(prop-2-en-1-ylsulfanyl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: C=CCSc1nc2c3ccccc3CC(c2c(=O)n1CC=C)(C)C

STK699864
Synonyms: 2-amino-4-{4-methoxy-3-[(3-methoxyphenoxy)methyl]phenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: COc1cccc(c1)OCc1cc(ccc1OC)C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C#N

STK699866
Synonyms: 2-{(2E)-2-[1-(4-bromophenyl)ethylidene]hydrazinyl}-3-methylquinoxaline
Smiles: Brc1ccc(cc1)/C(=N/Nc1nc2ccccc2nc1C)/C

STK699867
Synonyms: N-[(2E)-2-{[(5-bromofuran-2-yl)carbonyl]amino}-3-(4-bromophenyl)prop-2-enoyl]phenylalanine
Smiles: Brc1ccc(cc1)/C=C(\C(=O)NC(C(=O)O)Cc1ccccc1)/NC(=O)c1ccc(o1)Br

STK699868
Synonyms: 6-{[(2E)-2-{[(5-bromofuran-2-yl)carbonyl]amino}-3-(4-bromophenyl)prop-2-enoyl]amino}hexanoicacid
Smiles: OC(=O)CCCCCNC(=O)/C(=C\c1ccc(cc1)Br)/NC(=O)c1ccc(o1)Br

STK699869
Synonyms: 2-amino-1-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile
Smiles: N#Cc1c2nc3ccccc3nc2n(c1N)CCc1ccccc1

STK699870
Synonyms: 5,5-dimethyl-4-[(Z)-(4-nitrobenzylidene)(oxido)-lambda~5~-azanyl]-3-propyl-1,3-thiazolidine-2-thione
Smiles: CCCN1C(=S)SC(C1/[N+](=C/c1ccc(cc1)[N+](=O)[O-])/[O-])(C)C

STK699871
Synonyms: 3-butyl-4-[(Z)-(3,4-dimethoxybenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-1,3-thiazolidine-2-thione
Smiles: CCCCN1C(=S)SC(C1/[N+](=C/c1ccc(c(c1)OC)OC)/[O-])(C)C

STK699872
Synonyms: 3-methyl-8-(nonylsulfanyl)-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCSc1nc2c(n1CCCCC)c(=O)[nH]c(=O)n2C

STK699873
Synonyms: N,N-dibutyl-5,5-diphenylpent-4-en-2-yn-1-amine
Smiles: CCCCN(CC#C/C=C(/c1ccccc1)\c1ccccc1)CCCC

STK699874
Synonyms: 6,8-dichloro-3-[4-(9H-fluoren-2-yl)-1,3-thiazol-2-yl]-2H-chromen-2-one
Smiles: Clc1cc2cc(c3scc(n3)c3ccc4c(c3)Cc3c4cccc3)c(=O)oc2c(c1)Cl

STK699875
Synonyms: 3-methyl-7-pentyl-8-[(2-phenylethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(SCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK699876
Synonyms: 3-(3,4-dichlorophenyl)-1-(5,5-dimethyl-3-{[(E)-thiophen-2-ylmethylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxyurea
Smiles: O=C(N(C1N(/N=C/c2cccs2)C(=S)SC1(C)C)O)Nc1ccc(c(c1)Cl)Cl

STK699877
Synonyms: potassium(1,1-dioxidotetrahydrothiophen-3-yl)methylcarbamodithioate
Smiles: [S-]C(=S)N(C1CCS(=O)(=O)C1)C.[K+]

STK699878
Synonyms: 6,6-dimethyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3-phenyl-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(=C)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(SC3)(C)C

STK699879
Synonyms: 5-acetyl-4-(2-chlorophenyl)-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-methyl-1,4-dihydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)Cl)NC(=C(C1c1ccccc1Cl)C(=O)C)C

STK699880
Synonyms: 2-(4-benzylpiperazin-1-yl)-1-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)Cc1ccccc1)c(n2C)C

STK699881
Synonyms: 6-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)Br)NC(=C(C1c1ccccc1Cl)C(=O)Nc1ccccc1OC)C

STK699882
Synonyms: 6-chloro-3-[4-(9H-fluoren-2-yl)-1,3-thiazol-2-yl]-2H-chromen-2-one
Smiles: Clc1ccc2c(c1)cc(c(=O)o2)c1scc(n1)c1ccc2c(c1)Cc1c2cccc1

STK699883
Synonyms: 6-(benzylsulfanyl)-4-(2-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCc2ccccc2)NC(=C(C1c1ccccc1Cl)C(=O)Nc1ccccc1C)C

STK699884
Synonyms: 3-butyl-4-[(Z)-(2-methoxybenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-1,3-thiazolidine-2-thione
Smiles: CCCCN1C(=S)SC(C1/[N+](=C/c1ccccc1OC)/[O-])(C)C

STK699886
Synonyms: 3-benzyl-6-ethyl-6-methyl-2-(prop-2-en-1-ylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)(C)CC

STK699887
Synonyms: {[7-(2-chlorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C

STK699888
Synonyms: 2-chloroethyl2-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazole-1-carboxylate
Smiles: ClCCOC(=O)n1c(SCC(=O)N(CC)CC)nc2c1cccc2

STK699891
Synonyms: 3-[4-(9H-fluoren-2-yl)-1,3-thiazol-2-yl]-6-hexyl-2-oxo-2H-chromen-7-ylacetate
Smiles: CCCCCCc1cc2cc(c3scc(n3)c3ccc4c(c3)Cc3c4cccc3)c(=O)oc2cc1OC(=O)C

STK699892
Synonyms: N'-[(1E)-1-(6-bromo-2-oxo-2H-chromen-3-yl)ethylidene]pyridine-4-carbohydrazide
Smiles: Brc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccncc1)/C

STK699894
Synonyms: 3-(3-chlorophenyl)-1-hydroxy-1-(3-{[(E)-(2-methoxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)urea
Smiles: COc1ccccc1/C=N/N1C(=S)SC(C1N(C(=O)Nc1cccc(c1)Cl)O)(C)C

STK699895
Synonyms: 6-amino-3-tert-butyl-4-(2,3-dimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1OC)OC)c(n[nH]2)C(C)(C)C

STK699896
Synonyms: 8-methoxy-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: COc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK699897
Synonyms: 3-[4-(biphenyl-4-yl)-1,3-thiazol-2-yl]-2-oxo-2H-chromen-7-ylacetate
Smiles: CC(=O)Oc1ccc2c(c1)oc(=O)c(c2)c1scc(n1)c1ccc(cc1)c1ccccc1

STK699898
Synonyms: 2-(2-hydroxyethyl)-6-(morpholin-4-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: OCCn1c(=O)c2ccc(c3c2c(c1=O)ccc3)N1CCOCC1

STK699899
Synonyms: 4-[(2E)-2-benzylidenehydrazinyl]-2-(methylsulfanyl)pyrimidine
Smiles: CSc1nccc(n1)N/N=C/c1ccccc1

STK699900
Synonyms: 1'-(4-methyl-2-oxopentyl)spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
Smiles: CC(CC(=O)CN1c2ccccc2C2(C1=O)OCCO2)C

STK699902
Synonyms: sodiumS-(4-nitrophenyl)sulfurothioate
Smiles: [O-][N+](=O)c1ccc(cc1)SS(=O)(=O)[O-].[Na+]

STK699904
Synonyms: methyl3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-ene-2-carboxylate
Smiles: COC(=O)N1C2C=CC(C1(C(F)(F)F)C(F)(F)F)C2

STK699905
Synonyms: 5-[(Z)-(2-methoxybenzylidene)(oxido)-lambda~5~-azanyl]-3,4,4-trimethyl-1,3-thiazolidine-2-thione
Smiles: COc1ccccc1/C=[N+](/C1SC(=S)N(C1(C)C)C)\[O-]

STK699906
Synonyms: 4-[(Z)-benzylidene(oxido)-lambda~5~-azanyl]-5,5-dimethyl-3-propyl-1,3-thiazolidine-2-thione
Smiles: CCCN1C(=S)SC(C1/[N+](=C/c1ccccc1)/[O-])(C)C

STK699908
Synonyms: 3-methyl-8-[(2-oxopropyl)sulfanyl]-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(SCC(=O)C)nc2c1c(=O)[nH]c(=O)n2C

STK699909
Synonyms: 1-methyl-N,N'-diphenyl-1H-pyrazole-3,5-dicarboxamide
Smiles: O=C(c1nn(c(c1)C(=O)Nc1ccccc1)C)Nc1ccccc1

STK699910
Synonyms: 2-{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)N)nc(cc1C(F)(F)F)C

STK699912
Synonyms: 1-(3-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-cyclohexyl-1-hydroxyurea
Smiles: ON(C1N(/N=C/c2cc(Br)ccc2O)C(=S)SC1(C)C)C(=O)NC1CCCCC1

STK699913
Synonyms: 4-(2,3-dimethoxyphenyl)-6-methyl-N-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Smiles: COc1cccc(c1OC)C1NC(=O)NC(=C1C(=O)Nc1ccc(cc1)C)C

STK699915
Synonyms: 4-{acetyl[3-(morpholin-4-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]amino}benzoicacid
Smiles: CC(=O)N(C1=C(N2CCOCC2)C(=O)c2c(C1=O)cccc2)c1ccc(cc1)C(=O)O

STK699916
Synonyms: 11-[(5Z)-5-(4-bromobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]undecanoicacid
Smiles: OC(=O)CCCCCCCCCCN1C(=S)S/C(=C\c2ccc(cc2)Br)/C1=O

STK699918
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(2-methylprop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Clc1ccc(cc1)C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK699919
Synonyms: 3-(naphthalen-1-ylsulfanyl)-1-(4-{4-[3-(naphthalen-2-ylsulfanyl)-2,5-dioxopyrrolidin-1-yl]benzyl}phenyl)pyrrolidine-2,5-dione
Smiles: O=C1CC(C(=O)N1c1ccc(cc1)Cc1ccc(cc1)N1C(=O)CC(C1=O)Sc1cccc2c1cccc2)Sc1ccc2c(c1)cccc2

STK699920
Synonyms: butyl6-chloro-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
Smiles: CCCCOC(=O)n1c(=O)oc2c1ccc(c2)Cl

STK699921
Synonyms: 3-(3-chlorophenyl)-1-[5,5-dimethyl-3-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)-2-thioxo-1,3-thiazolidin-4-yl]-1-hydroxyurea
Smiles: CSc1ccc(cc1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1cccc(c1)Cl)O)(C)C

STK699923
Synonyms: 6,6-dimethyl-3-(prop-2-en-1-yl)-2-(propylsulfanyl)-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SCCC)nc2c(c1=O)c1CC(C)(C)SCc1s2

STK699924
Synonyms: 3-(4-chlorophenyl)-1-[3-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl]-1-hydroxyurea
Smiles: Clc1ccc(cc1)NC(=O)N(C1N(/N=C/c2ccc(cc2)N(C)C)C(=S)SC1(C)C)O

STK699925
Synonyms: (3E)-5-methyl-3-{[5-(2-nitrophenyl)furan-2-yl]methylidene}furan-2(3H)-one
Smiles: CC1=C/C(=C\c2ccc(o2)c2ccccc2[N+](=O)[O-])/C(=O)O1

STK699926
Synonyms: 8-chloro-7-(3,4-dichlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1Cl)Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C

STK699927
Synonyms: (4E)-N-hydroxy-2,6-diphenyl-3-(propan-2-yl)piperidin-4-imine
Smiles: O/N=C/1\CC(NC(C1C(C)C)c1ccccc1)c1ccccc1

STK699928
Synonyms: benzyl4-({(2E)-3-[4-(acetyloxy)phenyl]-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)butanoate
Smiles: O=C(OCc1ccccc1)CCCNC(=O)/C(=C\c1ccc(cc1)OC(=O)C)/NC(=O)c1ccccc1

STK699930
Synonyms: 1-(5,5-dimethyl-3-{[(E)-(4-methylphenyl)methylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-(4-nitrophenyl)urea
Smiles: Cc1ccc(cc1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(cc1)[N+](=O)[O-])O)(C)C

STK699931
Synonyms: ethyl(8S,8aR)-6-amino-5,7,7-tricyano-8-(3,4-dimethoxyphenyl)-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccc(c(c1)OC)OC)C(C(=C2C#N)N)(C#N)C#N

STK699933
Synonyms: 7-phenyl-6-azaspiro[4.5]decan-9-ol
Smiles: OC1CC(NC2(C1)CCCC2)c1ccccc1

STK699934
Synonyms: [1-amino-5-(piperidin-1-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl](4-bromophenyl)methanone
Smiles: Brc1ccc(cc1)C(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCCCC1

STK699936
Synonyms: N-(4-{[3-(naphthalen-2-ylamino)quinoxalin-2-yl]sulfamoyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccc2c(c1)cccc2

STK699938
Synonyms: 2-(2-methoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-6-carboxylicacid
Smiles: COc1ccccc1n1c(=O)c2cccc3c2c(c1=O)ccc3C(=O)O

STK699939
Synonyms: 6-amino-3-(methoxymethyl)-4-(2-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: COCc1n[nH]c2c1C(C(=C(O2)N)C#N)c1ccccc1OC

STK699940
Synonyms: 2-(ethylsulfanyl)-5,5-dimethyl-3-(2-methylprop-2-en-1-yl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CCSc1nc2c3ccccc3CC(c2c(=O)n1CC(=C)C)(C)C

STK699941
Synonyms: 3-(2-methylprop-2-en-1-yl)-2-[(2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CC(=C)Cn1c(SCCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK699942
Synonyms: 3-butyl-1-[3-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl]-1-hydroxyurea
Smiles: CCCCNC(=O)N(C1N(/N=C/c2ccc(cc2)N(C)C)C(=S)SC1(C)C)O

STK699943
Synonyms: 2,2,3,3,4,4,5,5,5-nonafluoropentyl(9E)-9-(hydroxyimino)-2,7-dinitro-9H-fluorene-4-carboxylate
Smiles: O/N=C\1/c2cc(cc(c2c2c1cc(cc2)[N+](=O)[O-])C(=O)OCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)[N+](=O)[O-]

STK699945
Synonyms: 5-(1-hydroxyethyl)-3-phenyl-2-thioxoimidazolidin-4-one
Smiles: CC(C1NC(=S)N(C1=O)c1ccccc1)O

STK699946
Synonyms: 2-[(2-hydroxyethyl)amino]-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: OCCNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCCC3

STK699947
Synonyms: 3-(4-chlorophenyl)-1-hydroxy-1-(3-{[(E)-(2-methoxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)urea
Smiles: COc1ccccc1/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(cc1)Cl)O)(C)C

STK699948
Synonyms: 6-ethyl-6-methyl-3-phenyl-2-(propan-2-ylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1)SC(C)C

STK699951
Synonyms: 3-(5,7-dimethyl-6-oxo-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)-N,N,1-trimethyl-1H-indole-5-sulfonamide
Smiles: CN(S(=O)(=O)c1ccc2c(c1)c(cn2C)[C@@H]1N2CC3(CN1CC(C2)(C3=O)C)C)C

STK699953
Synonyms: 3-methyl-8-[(2E)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C1Nc2c(/C/1=N\Nc1nc3c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n3C)cccc2

STK699954
Synonyms: methyl5-{1-[(furan-2-ylcarbonyl)amino]-8,8-dimethyl-5-(morpholin-4-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridin-2-yl}furan-2-carboxylate
Smiles: COC(=O)c1ccc(o1)c1sc2c(c1NC(=O)c1ccco1)c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK699955
Synonyms: 6-chloro-3-{2-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}-2H-chromen-2-one
Smiles: Clc1ccc2c(c1)cc(c(=O)o2)c1csc(n1)N/N=C/c1ccc(cc1)[N+](=O)[O-]

STK699956
Synonyms: N'-[(1E)-1-(6-bromo-2-oxo-2H-chromen-3-yl)ethylidene]-3-hydroxynaphthalene-2-carbohydrazide
Smiles: Brc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1cc2ccccc2cc1O)/C

STK699957
Synonyms: 3,6-diamino-4-(4-bromophenyl)-5-cyano-N-phenylthieno[2,3-b]pyridine-2-carboxamide
Smiles: N#Cc1c(N)nc2c(c1c1ccc(cc1)Br)c(N)c(s2)C(=O)Nc1ccccc1

STK699959
Synonyms: 5-chloro-N-[2-(3,4-dimethylphenyl)-2H-benzotriazol-5-yl]-2-iodobenzamide
Smiles: Clc1ccc(c(c1)C(=O)Nc1ccc2c(c1)nn(n2)c1ccc(c(c1)C)C)I

STK699960
Synonyms: 3,3-dimethyl-6-(morpholin-4-yl)-8-(propan-2-yl)-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(nc(c2c1CC(C)(C)SC2)C(C)C)N1CCOCC1

STK699961
Synonyms: 3,5-di(biphenyl-4-yl)-1-phenyl-4,5-dihydro-1H-pyrazole
Smiles: c1ccc(cc1)N1N=C(CC1c1ccc(cc1)c1ccccc1)c1ccc(cc1)c1ccccc1

STK699962
Synonyms: 5-[4-(octyloxy)phenyl]-1,3-thiaselenole-2-thione
Smiles: CCCCCCCCOc1ccc(cc1)c1c[se]c(=S)s1

STK699963
Synonyms: 1-(3-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-(3,4-dichlorophenyl)-1-hydroxyurea
Smiles: O=C(N(C1N(/N=C/c2c(F)cccc2Cl)C(=S)SC1(C)C)O)Nc1ccc(c(c1)Cl)Cl

STK699964
Synonyms: 1-amino-2-bromo-4-[(4-methylphenyl)amino]anthracene-9,10-dione
Smiles: Cc1ccc(cc1)Nc1cc(Br)c(c2c1C(=O)c1ccccc1C2=O)N

STK699967
Synonyms: 8-(heptylsulfanyl)-3-methyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCSc1nc2c(n1CCCCC)c(=O)[nH]c(=O)n2C

STK699970
Synonyms: (2E)-N-[2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)naphthalen-1-yl]-3-phenylprop-2-enamide
Smiles: O=C(Nc1c2ccccc2ccc1C(C(F)(F)F)(C(F)(F)F)O)/C=C/c1ccccc1

STK699971
Synonyms: [(8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]aceticacid
Smiles: OC(=O)COc1cc2oc(=O)c3c(c2cc1Cl)CCC3

STK699973
Synonyms: ({5-[2-(propan-2-yloxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)aceticacid
Smiles: OC(=O)CSc1nnc([nH]1)c1ccccc1OC(C)C

STK699974
Synonyms: 4-{(1E)-3-[(4-methylphenyl)amino]-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenyl4-methylbenzenesulfonate
Smiles: Cc1ccc(cc1)NC(=O)/C(=C\c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/NC(=O)c1ccccc1

STK699975
Synonyms: 3-(3,4-dichlorophenyl)-1-hydroxy-1-(3-{[(E)-(2-methoxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)urea
Smiles: COc1ccccc1/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(c(c1)Cl)Cl)O)(C)C

STK699979
Synonyms: 2-{2-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}-3H-benzo[f]chromen-3-one
Smiles: Clc1ccc(cc1)/C=N/Nc1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1

STK699982
Synonyms: 3-(4-chlorophenyl)-1-(5,5-dimethyl-3-{[(E)-thiophen-2-ylmethylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxyurea
Smiles: Clc1ccc(cc1)NC(=O)N(C1N(/N=C/c2cccs2)C(=S)SC1(C)C)O

STK699983
Synonyms: N'-[(1E)-1-(6,8-dibromo-2-oxo-2H-chromen-3-yl)ethylidene]-4-nitrobenzohydrazide
Smiles: Brc1cc(Br)c2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccc(cc1)[N+](=O)[O-])/C

STK699984
Synonyms: 5-bromo-N-[(1E)-3-[(2-hydroxyethyl)amino]-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
Smiles: OCCNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccc(o1)Br

STK699985
Synonyms: 4-{(1E)-3-[(4-methoxyphenyl)amino]-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenylacetate
Smiles: COc1ccc(cc1)NC(=O)/C(=C\c1ccc(cc1)OC(=O)C)/NC(=O)c1ccccc1

STK699987
Synonyms: N-[(E)-(4-methoxyphenyl)methylidene]-N'-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)benzene-1,4-diamine
Smiles: COc1ccc(cc1)/C=N/c1ccc(cc1)NC1=NCC(S1)C

STK699989
Synonyms: 5-(2-iodophenyl)-3,3-dimethyl-3,4,5,6-tetrahydrobenzo[a]phenanthridin-1(2H)-one
Smiles: O=C1CC(C)(C)CC2=C1c1c(NC2c2ccccc2I)ccc2c1cccc2

STK699990
Synonyms: 4-[(Z)-(2-methoxybenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-3-propyl-1,3-thiazolidine-2-thione
Smiles: CCCN1C(=S)SC(C1/[N+](=C/c1ccccc1OC)/[O-])(C)C

STK699992
Synonyms: 2-[(6-nitro-1,3-benzoxazol-2-yl)sulfanyl]-1-(piperidin-1-yl)ethanone
Smiles: O=C(N1CCCCC1)CSc1nc2c(o1)cc(cc2)[N+](=O)[O-]

STK699993
Synonyms: 7-dodecyl-3-methyl-8-[(3-phenylpropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SCCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK699994
Synonyms: 6-bromo-3-{2-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}-2H-chromen-2-one
Smiles: Brc1ccc(cc1)/C=N/Nc1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK699996
Synonyms: 5,5-dimethyl-4-[(Z)-oxido(thiophen-2-ylmethylidene)-lambda~5~-azanyl]-3-propyl-1,3-thiazolidine-2-thione
Smiles: CCCN1C(=S)SC(C1/[N+](=C/c1cccs1)/[O-])(C)C

STK699997
Synonyms: 5,5-dimethyl-4-[(Z)-(3-nitrobenzylidene)(oxido)-lambda~5~-azanyl]-3-(prop-2-en-1-yl)-1,3-thiazolidine-2-thione
Smiles: C=CCN1C(=S)SC(C1/[N+](=C/c1cccc(c1)[N+](=O)[O-])/[O-])(C)C

STK699998
Synonyms: 7-(3-bromobenzyl)-8-(4-chloro-3,5-dimethylphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1cccc(c1)Cn1c(Oc2cc(C)c(c(c2)C)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK699999
Synonyms: 5,5-dimethyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3-(prop-2-en-1-yl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: C=CCn1c(SCC(=C)C)nc2c(c1=O)C(C)(C)Cc1c2cccc1

STK700001
Synonyms: (3E)-3-[(5-bromofuran-2-yl)methylidene]-5-methylfuran-2(3H)-one
Smiles: CC1=C/C(=C\c2ccc(o2)Br)/C(=O)O1

STK700002
Synonyms: 2-(4-fluorophenyl)-1H-phenanthro[9,10-d]imidazole
Smiles: Fc1ccc(cc1)c1nc2c([nH]1)c1ccccc1c1c2cccc1

STK700004
Synonyms: 7-hexyl-3-methyl-8-(nonylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCSc1nc2c(n1CCCCCC)c(=O)[nH]c(=O)n2C

STK700005
Synonyms: 4-hydroxy-2-oxo-N'-tetradecanoyl-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CCCCCCCCCCCCCC(=O)NNC(=O)c1c(=O)[nH]c2c(c1O)cccc2

STK700006
Synonyms: 6-ethyl-6-methyl-2-(methylsulfanyl)-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SC)nc2c(c1=O)c1CC(C)(CC)OCc1s2

STK700007
Synonyms: bisbenzimidazo[2,1-b:2',1'-i]benzo[lmn][3,8]phenanthroline-8,17-dione
Smiles: O=c1c2ccc3c4c2c(c2n1c1ccccc1n2)ccc4c(=O)n1c3nc2c1cccc2

STK700011
Synonyms: 3-benzyl-2-(benzylsulfanyl)-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=O)Cc1ccccc1)SCc1ccccc1

STK700012
Synonyms: 1-(4-bromobenzyl)-8-(2,5-dimethylphenoxy)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)Oc1cc(C)ccc1C

STK700014
Synonyms: (2Z)-3-(4-chlorophenyl)-2-{4-[4-(phenylsulfanyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(cc1)Cl)/c1scc(n1)c1ccc(cc1)Sc1ccccc1

STK700016
Synonyms: 4-[(Z)-(2-fluorobenzylidene)(oxido)-lambda~5~-azanyl]-3,5,5-trimethyl-1,3-thiazolidine-2-thione
Smiles: [O-]/[N+](=C\c1ccccc1F)/C1N(C)C(=S)SC1(C)C

STK700017
Synonyms: 4-hydroxy-1,1,2,5-tetramethyl-4-phenylpiperidinium
Smiles: CC1C[N+](C)(C)C(CC1(O)c1ccccc1)C

STK700019
Synonyms: 3-cyclohexyl-1-(3-{[(E)-(2-fluorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxyurea
Smiles: O=C(N(C1N(/N=C/c2ccccc2F)C(=S)SC1(C)C)O)NC1CCCCC1

STK700020
Synonyms: ethyl5-(acetyloxy)-6-bromo-2-{[(3-cyano-6-methylpyridin-2-yl)sulfanyl]methyl}-1-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c2cc(OC(=O)C)c(cc2n(c1CSc1nc(C)ccc1C#N)C)Br

STK700021
Synonyms: 8-[(2-chlorobenzyl)sulfanyl]-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(SCc2ccccc2Cl)nc2c1c(=O)[nH]c(=O)n2C

STK700024
Synonyms: (2E)-2-{1-[4-(phenylsulfanyl)phenyl]ethylidene}hydrazinecarbothioamide
Smiles: NC(=S)N/N=C(/c1ccc(cc1)Sc1ccccc1)\C

STK700026
Synonyms: 1-(3-{[(E)-(4-chlorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-(4-nitrophenyl)urea
Smiles: Clc1ccc(cc1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(cc1)[N+](=O)[O-])O)(C)C

STK700027
Synonyms: 1-hydroxy-1-(3-{[(E)-(2-hydroxynaphthalen-1-yl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-methylurea
Smiles: CNC(=O)N(C1N(/N=C/c2c(O)ccc3c2cccc3)C(=S)SC1(C)C)O

STK700028
Synonyms: 4-{(1E)-3-amino-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenyl4-methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)/C=C(\C(=O)N)/NC(=O)c1ccccc1

STK700029
Synonyms: 7-methyl-2-oxopyrido[1,2-a][1,3]thiazolo[5,4-e]pyrimidin-10-ium-1-ide
Smiles: Cc1cc[n+]2c(c1)ncc1c2[n-]c(=O)s1

STK700031
Synonyms: 2,7,8,9-tetramethyl-4H-pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-4-one
Smiles: Cc1oc(=O)c2c(n1)c1c(s2)nc(c(c1C)C)C

STK700032
Synonyms: 4-[(Z)-(2-chloro-6-fluorobenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-3-propyl-1,3-thiazolidine-2-thione
Smiles: CCCN1C(=S)SC(C1/[N+](=C/c1c(F)cccc1Cl)/[O-])(C)C

STK700034
Synonyms: (4-ethylphenyl)(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-yl)methanone
Smiles: CCc1ccc(cc1)C(=O)C12CN3CN(C2)CN(C1)C3

STK700035
Synonyms: 7-dodecyl-8-(dodecylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1CCCCCCCCCCCC)c(=O)[nH]c(=O)n2C

STK700036
Synonyms: 6,8-dichloro-3-{4-[4-(phenylsulfanyl)phenyl]-1,3-thiazol-2-yl}-2H-chromen-2-one
Smiles: Clc1cc(Cl)c2c(c1)cc(c(=O)o2)c1scc(n1)c1ccc(cc1)Sc1ccccc1

STK700037
Synonyms: 1-[(4-methylphenyl)amino]-3H-naphtho[1,2,3-de]quinoline-2,7-dione
Smiles: Cc1ccc(cc1)Nc1c(=O)[nH]c2c3c1c1ccccc1c(=O)c3ccc2

STK700038
Synonyms: 3-[5-(4-butylcyclohexyl)pyridin-2-yl]-5-fluorobenzenediazonium
Smiles: CCCCC1CCC(CC1)c1ccc(nc1)c1cc(F)cc(c1)[N+]#N

STK700039
Synonyms: 4-[(Z)-(2-methoxybenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-3-phenyl-1,3-thiazolidine-2-thione
Smiles: COc1ccccc1/C=[N+](/C1N(c2ccccc2)C(=S)SC1(C)C)\[O-]

STK700043
Synonyms: 8-(decylsulfanyl)-7-hexyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCSc1nc2c(n1CCCCCC)c(=O)[nH]c(=O)n2C

STK700045
Synonyms: 1-(5,5-dimethyl-3-{[(E)-(4-nitrophenyl)methylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-(4-nitrophenyl)urea
Smiles: [O-][N+](=O)c1ccc(cc1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(cc1)[N+](=O)[O-])O)(C)C

STK700046
Synonyms: 4-bromo-2-(2,3-dihydro-1H-benzo[f]cyclopenta[c]quinolin-4-yl)phenol
Smiles: Brc1ccc(c(c1)c1nc2ccc3c(c2c2c1CCC2)cccc3)O

STK700048
Synonyms: ethyl6-amino-4-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-5-cyano-2-propyl-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(CCC)OC(=C(C1c1c(C)nn(c1Cl)c1ccccc1)C#N)N

STK700050
Synonyms: 1-(3-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-(4-nitrophenyl)urea
Smiles: COc1ccc(cc1OC)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(cc1)[N+](=O)[O-])O)(C)C

STK700051
Synonyms: 3-chloro-N-{1,1,1,3,3,3-hexafluoro-2-[(2-fluorophenyl)amino]propan-2-yl}benzamide
Smiles: Clc1cccc(c1)C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1ccccc1F

STK700052
Synonyms: 3-(4-chlorophenyl)-1-(5,5-dimethyl-3-{[(E)-(4-methylphenyl)methylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxyurea
Smiles: Cc1ccc(cc1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(cc1)Cl)O)(C)C

STK700053
Synonyms: 8-(decylsulfanyl)-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SCCCCCCCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK700054
Synonyms: methyl1-amino-5-(morpholin-4-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate
Smiles: COC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK700055
Synonyms: 4-oxo-2-{[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]sulfanyl}-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
Smiles: N#CC1C(=O)NC(=C(C21CCCCC2)C#N)SCC(=O)C12CC3CC(C2)CC(C1)C3

STK700058
Synonyms: 1-(3-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-(3-chlorophenyl)-1-hydroxyurea
Smiles: Clc1cccc(c1)NC(=O)N(C1N(/N=C/c2c(F)cccc2Cl)C(=S)SC1(C)C)O

STK700059
Synonyms: N-(4-bromophenyl)-6-hexyl-7-hydroxy-2-imino-2H-chromene-3-carboxamide
Smiles: CCCCCCc1cc2cc(C(=O)Nc3ccc(cc3)Br)c(=N)oc2cc1O

STK700062
Synonyms: 3-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-6-(3,4-dimethoxybenzyl)-1,2,4-triazin-5(2H)-one
Smiles: COc1cc(ccc1OC)Cc1n[nH]c(nc1=O)N/N=C/c1ccc(cc1)Br

STK700063
Synonyms: (5E)-3-[3-(2-chloro-10H-phenothiazin-10-yl)-3-oxopropyl]-5-(4-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Cc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CCC(=O)N1c2ccccc2Sc2c1cc(Cl)cc2

STK700064
Synonyms: 1-hydroxy-1-(3-{[(E)-(2-methoxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-phenylurea
Smiles: COc1ccccc1/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccccc1)O)(C)C

STK700065
Synonyms: 1'-(2-oxopentyl)spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
Smiles: CCCC(=O)CN1c2ccccc2C2(C1=O)OCCO2

STK700066
Synonyms: 8-[(2-chlorobenzyl)sulfanyl]-3-methyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(SCc2ccccc2Cl)nc2c1c(=O)[nH]c(=O)n2C

STK700067
Synonyms: 8-bromo-7-(2-chlorobenzyl)-3-methyl-1-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(=O)c2n(Cc3ccccc3Cl)c(nc2n(c1=O)C)Br

STK700068
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK700069
Synonyms: 2-{2-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}-3H-benzo[f]chromen-3-one
Smiles: Brc1ccc(cc1)/C=N/Nc1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1

STK700070
Synonyms: 4-[(Z)-(4-chlorobenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-3-phenyl-1,3-thiazolidine-2-thione
Smiles: [O-]/[N+](=C\c1ccc(cc1)Cl)/C1N(C(=S)SC1(C)C)c1ccccc1

STK700071
Synonyms: 6-methyl-2-(prop-2-en-1-ylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: C=CCSc1nc2sc3c(c2c(=O)[nH]1)CC(CC3)C

STK700072
Synonyms: N-[(2E)-2-{[(5-bromofuran-2-yl)carbonyl]amino}-3-(3-nitrophenyl)prop-2-enoyl]glycine
Smiles: OC(=O)CNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccc(o1)Br

STK700073
Synonyms: 1,1'-[(2,5-dimethoxybenzene-1,4-diyl)dimethanediyl]bis(2,4,5-tribromo-1H-imidazole)
Smiles: COc1cc(Cn2c(Br)nc(c2Br)Br)c(cc1Cn1c(Br)nc(c1Br)Br)OC

STK700074
Synonyms: 5-(4-methoxyphenyl)-3-phenyl-2-(3,4,4-trimethyl-2-thioxo-1,3-thiazolidin-5-yl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1ccccc1)C1SC(=S)N(C1(C)C)C

STK700076
Synonyms: 3-cyclohexyl-1-hydroxy-1-(3-{[(E)-(2-methoxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)urea
Smiles: COc1ccccc1/C=N/N1C(=S)SC(C1N(C(=O)NC1CCCCC1)O)(C)C

STK700077
Synonyms: 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-(4-methoxyphenyl)propanenitrile
Smiles: N#CCC(c1ccc(cc1)OC)C1CCOC(C1)(C)C

STK700078
Synonyms: N-{3-[(4-chlorophenyl)amino]quinoxalin-2-yl}-4-nitrobenzenesulfonamide
Smiles: Clc1ccc(cc1)Nc1nc2ccccc2nc1NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

STK700079
Synonyms: 5-chloro-N,N-dimethyl-1,3-benzoxazol-2-amine
Smiles: Clc1ccc2c(c1)nc(o2)N(C)C

STK700080
Synonyms: 6-nitro-3-(2-oxopropyl)-2H-chromen-2-one
Smiles: CC(=O)Cc1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK700081
Synonyms: 6,8-dibromo-3-{2-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-1,3-thiazol-4-yl}-2H-chromen-2-one
Smiles: COc1ccc(cc1)/C=N/Nc1scc(n1)c1cc2cc(Br)cc(c2oc1=O)Br

STK700082
Synonyms: 7-(2-chlorobenzyl)-8-[(2-chlorobenzyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1CSc1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C

STK700084
Synonyms: 3-(3,4-dichlorophenyl)-1-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)-1-[3-(trifluoromethyl)phenyl]urea
Smiles: CC1CN=C(S1)N(c1cccc(c1)C(F)(F)F)C(=O)Nc1ccc(c(c1)Cl)Cl

STK700085
Synonyms: 3-methyl-7-nonyl-8-[(3-phenylpropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(SCCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK700087
Synonyms: 3-(3,4-dichlorophenyl)-1-(5,5-dimethyl-3-{[(E)-(4-methylphenyl)methylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxyurea
Smiles: Cc1ccc(cc1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(c(c1)Cl)Cl)O)(C)C

STK700088
Synonyms: 1-(5,5-dimethyl-3-{[(E)-(4-methylphenyl)methylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-phenylurea
Smiles: Cc1ccc(cc1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccccc1)O)(C)C

STK700089
Synonyms: 8-[(3-chloro-2-hydroxypropyl)sulfanyl]-7-hexyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(SCC(CCl)O)nc2c1c(=O)[nH]c(=O)n2C

STK700090
Synonyms: 11-methyl-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7(11H)-one
Smiles: Cn1ncn2c1nc1c3ccccc3CC3(c1c2=O)CCCC3

STK700091
Synonyms: 2-({4-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]phenyl}amino)-3-(piperidin-1-yl)naphthalene-1,4-dione
Smiles: Oc1ccc(cc1)/C=C/C(=O)c1ccc(cc1)NC1=C(N2CCCCC2)C(=O)c2c(C1=O)cccc2

STK700092
Synonyms: 1-(3-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-(4-chlorophenyl)-1-hydroxyurea
Smiles: Clc1ccc(cc1)NC(=O)N(C1N(/N=C/c2c(F)cccc2Cl)C(=S)SC1(C)C)O

STK700095
Synonyms: (3-nitrophenyl)(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-yl)methanol
Smiles: OC(C12CN3CN(C2)CN(C1)C3)c1cccc(c1)[N+](=O)[O-]

STK700096
Synonyms: 1-ethyl-3,5-dimethyl-2,6-diphenylpiperidin-4-one
Smiles: CCN1C(c2ccccc2)C(C)C(=O)C(C1c1ccccc1)C

STK700098
Synonyms: 4-[(Z)-(3,4-dimethoxybenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-3-phenyl-1,3-thiazolidine-2-thione
Smiles: COc1cc(ccc1OC)/C=[N+](/C1N(C(=S)SC1(C)C)c1ccccc1)\[O-]

STK700099
Synonyms: (2E)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(2,4-dimethylphenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(cc1C)C)/c1scc(n1)c1ccc(cc1)Br

STK700100
Synonyms: 4-hydroxy-1-methyl-2-oxo-N'-tridecanoyl-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CCCCCCCCCCCCC(=O)NNC(=O)c1c(O)c2ccccc2n(c1=O)C

STK700101
Synonyms: 3-iodo-N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]benzamide
Smiles: Ic1cccc(c1)C(=O)Nc1cc(ccc1C)c1nc2c(o1)cccn2

STK700103
Synonyms: methyl3,3,3-trifluoro-2-{4-[(1,1,1,3,3,3-hexafluoro-2-{[(4-methylphenyl)carbonyl]amino}propan-2-yl)amino]-3-methoxyphenyl}-2-hydroxypropanoate
Smiles: COC(=O)C(C(F)(F)F)(c1ccc(c(c1)OC)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccc(cc1)C)O

STK700105
Synonyms: 5-bromo-N-{(1E)-1-(4-bromophenyl)-3-[(4-nitrophenyl)amino]-3-oxoprop-1-en-2-yl}furan-2-carboxamide
Smiles: Brc1ccc(cc1)/C=C(\C(=O)Nc1ccc(cc1)[N+](=O)[O-])/NC(=O)c1ccc(o1)Br

STK700108
Synonyms: 8-(benzylsulfanyl)-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK700109
Synonyms: 7-benzyl-2-(benzylsulfanyl)-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: O=c1c2c(sc3c2CCN(C3)Cc2ccccc2)nc(n1c1ccccc1)SCc1ccccc1

STK700111
Synonyms: N-(4-bromophenyl)-N-[3-(dimethylamino)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]acetamide
Smiles: Brc1ccc(cc1)N(C1=C(N(C)C)C(=O)c2c(C1=O)cccc2)C(=O)C

STK700112
Synonyms: 1-(4-bromobenzyl)-8-chloro-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)Cn1c(=O)c2n(C)c(nc2n(c1=O)C)Cl

STK700113
Synonyms: 8-(decylsulfanyl)-3-methyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCSc1nc2c(n1CCCCC)c(=O)[nH]c(=O)n2C

STK700115
Synonyms: 2-thioxo-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: O=c1[nH]c(=S)[nH]c2c1C1(CCCCC1)Cc1c2cccc1

STK700116
Synonyms: 3-(3,4-dichlorophenyl)-1-(3-{[(E)-(2-fluorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxyurea
Smiles: O=C(N(C1N(/N=C/c2ccccc2F)C(=S)SC1(C)C)O)Nc1ccc(c(c1)Cl)Cl

STK700121
Synonyms: 1-[(2-chlorophenyl)carbonyl]proline
Smiles: OC(=O)C1CCCN1C(=O)c1ccccc1Cl

STK700122
Synonyms: 1-(methylamino)-4-(piperidin-1-yl)anthracene-9,10-dione
Smiles: CNc1ccc(c2c1C(=O)c1ccccc1C2=O)N1CCCCC1

STK700123
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5,5-dimethyl-3-(2-methylprop-2-en-1-yl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CC(=C)Cn1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)C(C)(C)Cc1c2cccc1

STK700124
Synonyms: 8-[(2-chlorobenzyl)sulfanyl]-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SCc2ccccc2Cl)nc2c1c(=O)[nH]c(=O)n2C

STK700125
Synonyms: 8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-ylN-[(benzyloxy)carbonyl]-4-chlorophenylalaninate
Smiles: O=C(NC(C(=O)Oc1cc2oc(=O)c3c(c2cc1Cl)CCC3)Cc1ccc(cc1)Cl)OCc1ccccc1

STK700126
Synonyms: iron(2+)bis{S-[4-(diethylamino)phenyl]sulfurothioate}
Smiles: CCN(c1ccc(cc1)SS(=O)(=O)[O-])CC.CCN(c1ccc(cc1)SS(=O)(=O)[O-])CC.[Fe+2]

STK700127
Synonyms: 3-butyl-4-[(Z)-(4-chlorobenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-1,3-thiazolidine-2-thione
Smiles: CCCCN1C(=S)SC(C1/[N+](=C/c1ccc(cc1)Cl)/[O-])(C)C

STK700128
Synonyms: 8-(dodecylsulfanyl)-7-hexyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1CCCCCC)c(=O)[nH]c(=O)n2C

STK700129
Synonyms: 4-bromo-2-(1,2,3,4-tetrahydrobenzo[a]phenanthridin-5-yl)phenol
Smiles: Brc1ccc(c(c1)c1nc2ccc3c(c2c2c1CCCC2)cccc3)O

STK700130
Synonyms: 6-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-{[(5-bromofuran-2-yl)carbonyl]amino}prop-2-enoyl]amino}hexanoicacid
Smiles: OC(=O)CCCCCNC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccc(o1)Br

STK700132
Synonyms: 7-(2-chlorobenzyl)-8-(dodecylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C

STK700133
Synonyms: 3-benzyl-5,5-dimethyl-4-[(Z)-[(2E)-3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene](oxido)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione
Smiles: [O-]/[N+](=C\C=C\c1ccc(o1)[N+](=O)[O-])/C1N(Cc2ccccc2)C(=S)SC1(C)C

STK700135
Synonyms: (2E)-3-(biphenyl-4-yl)-2-[4-(furan-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(cc1)c1ccccc1)/c1scc(n1)c1ccco1

STK700139
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-5,5-dimethyl-3-(2-methylprop-2-en-1-yl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CC(=C)Cn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C(C)(C)Cc1c2cccc1

STK700140
Synonyms: 1-hydroxy-1-(3-{[(E)-1H-indol-3-ylmethylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-(4-nitrophenyl)urea
Smiles: O=C(N(C1N(/N=C/c2c[nH]c3c2cccc3)C(=S)SC1(C)C)O)Nc1ccc(cc1)[N+](=O)[O-]

STK700141
Synonyms: 5-cyano-6-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)OC)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK700142
Synonyms: 5,5-dimethyl-3-(2-methylprop-2-en-1-yl)-2-(methylsulfanyl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CSc1nc2c3ccccc3CC(c2c(=O)n1CC(=C)C)(C)C

STK700143
Synonyms: 2,2',2''-methanetriyltris[5-(4-methylphenyl)furan]
Smiles: Cc1ccc(cc1)c1ccc(o1)C(c1ccc(o1)c1ccc(cc1)C)c1ccc(o1)c1ccc(cc1)C

STK700144
Synonyms: 8-nitro-1,3,6-triazatricyclo[4.3.1.1~3,8~]undecane
Smiles: [O-][N+](=O)C12CN3CCN(C1)CN(C2)C3

STK700145
Synonyms: 2-[2-(4-bromophenyl)-2-oxoethyl]-1-ethyl-6-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium
Smiles: CCC1=[N+](CCn2c1ccc2C)CC(=O)c1ccc(cc1)Br

STK700146
Synonyms: N-{(1E)-3-(benzylamino)-3-oxo-1-[4-(propan-2-yloxy)phenyl]prop-1-en-2-yl}-5-bromofuran-2-carboxamide
Smiles: CC(Oc1ccc(cc1)/C=C(\C(=O)NCc1ccccc1)/NC(=O)c1ccc(o1)Br)C

STK700148
Synonyms: ethyl(4S)-6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(2-nitrophenyl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(CC(=O)OCC)OC(=C([C@@H]1c1ccccc1[N+](=O)[O-])C#N)N

STK700149
Synonyms: 2-methylpropyl6-nitro-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
Smiles: CC(COC(=O)n1c(=O)oc2c1ccc(c2)[N+](=O)[O-])C

STK700150
Synonyms: 4-[(Z)-(4-hydroxybenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-3-propyl-1,3-thiazolidine-2-thione
Smiles: CCCN1C(=S)SC(C1/[N+](=C/c1ccc(cc1)O)/[O-])(C)C

STK700151
Synonyms: 3-butyl-5,5-dimethyl-4-[(Z)-[(2E)-3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene](oxido)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione
Smiles: CCCCN1C(=S)SC(C1/[N+](=C/C=C/c1ccc(o1)[N+](=O)[O-])/[O-])(C)C

STK700153
Synonyms: N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}-2-phenylacetamide(non-preferredname)
Smiles: O=C(N/N=C(/Cc1ccccc1)\C)CNC(=O)Cc1ccccc1

STK700155
Synonyms: 2-(2-fluorophenyl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Smiles: Fc1ccccc1N1C(=O)C2C(C1=O)C(C=CC2c1ccccc1)c1ccccc1

STK700156
Synonyms: 3-(2-methylprop-2-en-1-yl)-2-(prop-2-yn-1-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: C#CCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK700157
Synonyms: 7-[(E)-hydrazinylidene(3-nitrophenyl)methyl]-1,3,5-triazatricyclo[3.3.1.1~3,7~]decane
Smiles: N/N=C(/C12CN3CN(C2)CN(C1)C3)\c1cccc(c1)[N+](=O)[O-]

STK700158
Synonyms: ethylN-(3-chloro-2-methylphenyl)-3,3,3-trifluoro-2-[(3-methylbutanoyl)amino]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1cccc(c1C)Cl)NC(=O)CC(C)C

STK700159
Synonyms: 1-(5,5-dimethyl-3-{[(E)-pyridin-3-ylmethylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-(4-nitrophenyl)urea
Smiles: O=C(N(C1N(/N=C/c2cccnc2)C(=S)SC1(C)C)O)Nc1ccc(cc1)[N+](=O)[O-]

STK700160
Synonyms: 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-[(1E)-1-(4-nitrophenyl)ethylidene]acetohydrazide(non-preferredname)
Smiles: O=C(N/N=C(/c1ccc(cc1)[N+](=O)[O-])\C)CC1NC(=NNC1=O)Cc1ccccc1

STK700161
Synonyms: 2-chloroethyl6-chloro-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
Smiles: ClCCOC(=O)n1c(=O)oc2c1ccc(c2)Cl

STK700162
Synonyms: 3-{2-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}-6,8-dichloro-2H-chromen-2-one
Smiles: Brc1ccc(cc1)/C=N/Nc1scc(n1)c1cc2cc(Cl)cc(c2oc1=O)Cl

STK700163
Synonyms: 2-(benzylsulfanyl)-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: O=c1c2c(sc3c2CC(C)(C)SC3)nc(n1c1ccccc1)SCc1ccccc1

STK700166
Synonyms: 3-benzyl-5,5-dimethyl-4-[(Z)-(4-methylbenzylidene)(oxido)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione
Smiles: [O-]/[N+](=C\c1ccc(cc1)C)/C1N(Cc2ccccc2)C(=S)SC1(C)C

STK700168
Synonyms: 1,2,3-trichloro-4-(cyclohexylamino)anthracene-9,10-dione
Smiles: Clc1c(Cl)c(NC2CCCCC2)c2c(c1Cl)C(=O)c1c(C2=O)cccc1

STK700170
Synonyms: 2-[(4-tert-butylphenyl)(methyl)amino]-1-hydroxyanthracene-9,10-dione
Smiles: CN(c1ccc2c(c1O)C(=O)c1c(C2=O)cccc1)c1ccc(cc1)C(C)(C)C

STK700171
Synonyms: N-[(2E)-2-{[(5-bromofuran-2-yl)carbonyl]amino}-3-(4-bromophenyl)prop-2-enoyl]leucine
Smiles: CC(CC(C(=O)O)NC(=O)/C(=C\c1ccc(cc1)Br)/NC(=O)c1ccc(o1)Br)C

STK700173
Synonyms: 6-amino-3-(methoxymethyl)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: COCc1n[nH]c2c1C(c1cc(OC)c(c(c1)OC)OC)C(=C(O2)N)C#N

STK700174
Synonyms: 5-bromo-2-iodo-N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]benzamide
Smiles: Brc1ccc(c(c1)C(=O)Nc1cccc(c1C)c1nc2c(o1)cccn2)I

STK700177
Synonyms: N'-{(1Z)-1-[7-(diethylamino)-2-oxo-2H-chromen-3-yl]ethylidene}benzohydrazide
Smiles: CCN(c1ccc2c(c1)oc(=O)c(c2)/C(=N\NC(=O)c1ccccc1)/C)CC

STK700178
Synonyms: N,N'-cyclohexa-2,5-diene-1,4-diylidenebis(4-ethylbenzenesulfonamide)
Smiles: CCc1ccc(cc1)S(=O)(=O)/N=C/1\C=C/C(=N\S(=O)(=O)c2ccc(cc2)CC)/C=C1

STK700180
Synonyms: 2-[(hexylamino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Smiles: CCCCCCNC=C1C(=O)CC(CC1=O)(C)C

STK700181
Synonyms: 3-[(5Z)-5-(2-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]propanamide
Smiles: COc1ccccc1/C=C/1\SC(=S)N(C1=O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1

STK700182
Synonyms: 1-(3-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-phenylurea
Smiles: O=C(N(C1N(/N=C/c2c(F)cccc2Cl)C(=S)SC1(C)C)O)Nc1ccccc1

STK700183
Synonyms: 5-(5-bromo-2-methoxyphenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Smiles: COc1ccc(cc1C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3)Br

STK700184
Synonyms: 5-cyano-2-methyl-N-phenyl-4-(thiophen-2-yl)-6-thioxo-1,6-dihydropyridine-3-carboxamide
Smiles: N#Cc1c(=S)[nH]c(c(c1c1cccs1)C(=O)Nc1ccccc1)C

STK700187
Synonyms: 6,8-dichloro-N-(4-chlorophenyl)-2-imino-2H-chromene-3-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc2cc(Cl)cc(c2oc1=N)Cl

STK700188
Synonyms: 5,5-dimethyl-4-[(Z)-[4-(methylsulfanyl)benzylidene](oxido)-lambda~5~-azanyl]-3-phenyl-1,3-thiazolidine-2-thione
Smiles: CSc1ccc(cc1)/C=[N+](/C1N(C(=S)SC1(C)C)c1ccccc1)\[O-]

STK700189
Synonyms: 6-amino-4-(4-hydroxy-3-methoxy-5-nitrophenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc(OC)c(c(c1)[N+](=O)[O-])O)c(C)n[nH]2

STK700190
Synonyms: N-(2-hydroxyphenyl)-6-[(5E)-5-(3-{6-[(2-hydroxyphenyl)amino]-6-oxohexyl}-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanamide
Smiles: O=C(Nc1ccccc1O)CCCCCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCCCCC(=O)Nc2ccccc2O)/C1=O

STK700191
Synonyms: 6-benzyl-3-[(2E)-2-(2-hydroxybenzylidene)hydrazinyl]-1,2,4-triazin-5(2H)-one
Smiles: O=c1nc(N/N=C/c2ccccc2O)[nH]nc1Cc1ccccc1

STK700192
Synonyms: N'-[(E)-(2-hydroxynaphthalen-1-yl)methylidene]-3,4-dimethoxybenzohydrazide
Smiles: COc1cc(ccc1OC)C(=O)N/N=C/c1c(O)ccc2c1cccc2

STK700193
Synonyms: 6-ethyl-6-methyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1)SCC(=O)c1ccccc1

STK700194
Synonyms: N-(pyridin-3-ylcarbonyl)-beta-alanine
Smiles: OC(=O)CCNC(=O)c1cccnc1

STK700195
Synonyms: 1,5-dimethyl-4-{[(E)-(5-methylfuran-2-yl)methylidene]amino}-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(o1)/C=N/c1c(=O)n(n(c1C)C)c1ccccc1

STK700196
Synonyms: N'-[(3E)-5-bromo-2-oxo-1-(piperidin-1-ylmethyl)-1,2-dihydro-3H-indol-3-ylidene]-2-({[(E)-(4-methoxyphenyl)methylidene]amino}oxy)acetohydrazide
Smiles: COc1ccc(cc1)/C=N/OCC(=O)N/N=C\1/C(=O)N(c2c1cc(Br)cc2)CN1CCCCC1

STK700197
Synonyms: 1-chloro-4-{(2E)-2-[1-(pyridin-3-yl)ethylidene]hydrazinyl}phthalazine
Smiles: C/C(=N\Nc1nnc(c2c1cccc2)Cl)/c1cccnc1

STK700198
Synonyms: 5,5-dimethyl-4-[(Z)-(4-methylbenzylidene)(oxido)-lambda~5~-azanyl]-3-phenyl-1,3-thiazolidine-2-thione
Smiles: [O-]/[N+](=C\c1ccc(cc1)C)/C1N(C(=S)SC1(C)C)c1ccccc1

STK700200
Synonyms: 2,2'-[(benzylimino)dimethanediyl]bis(5-chloro-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione)
Smiles: ClC1=CCC2C(C1)C(=O)N(C2=O)CN(CN1C(=O)C2C(C1=O)CC(=CC2)Cl)Cc1ccccc1

STK700201
Synonyms: 2-phenyl-N'-(3,6,6-trimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)acetohydrazide
Smiles: O=C(Cc1ccccc1)NNc1nc2sc3c(c2c(=O)n1C)CC(OC3)(C)C

STK700202
Synonyms: naphthalen-2-yl(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-yl)methanone
Smiles: O=C(C12CN3CN(C2)CN(C1)C3)c1ccc2c(c1)cccc2

STK700203
Synonyms: N'-[(1E)-1-(2-oxo-2H-chromen-3-yl)ethylidene]pyridine-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1ccncc1)/c1cc2ccccc2oc1=O

STK700204
Synonyms: 8-(heptylsulfanyl)-7-hexyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCSc1nc2c(n1CCCCCC)c(=O)[nH]c(=O)n2C

STK700205
Synonyms: 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-thioxo-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: O=c1n(C2CCOC(C2)(C)C)c(=S)[nH]c2c1C1(CCCC1)Cc1c2cccc1

STK700206
Synonyms: 5-bromo-N-{(1E)-1-(4-bromophenyl)-3-[(4-methoxyphenyl)amino]-3-oxoprop-1-en-2-yl}furan-2-carboxamide
Smiles: COc1ccc(cc1)NC(=O)/C(=C\c1ccc(cc1)Br)/NC(=O)c1ccc(o1)Br

STK700207
Synonyms: 5-(1H-imidazol-5-ylmethyl)-3-phenyl-2-thioxoimidazolidin-4-one
Smiles: S=C1NC(C(=O)N1c1ccccc1)Cc1cnc[nH]1

STK700209
Synonyms: 4-{(Z)-[(5,5-dimethyl-3-phenyl-2-thioxo-1,3-thiazolidin-4-yl)(oxido)-lambda~5~-azanylidene]methyl}-N-methylbenzenesulfonamide
Smiles: CNS(=O)(=O)c1ccc(cc1)/C=[N+](/C1N(C(=S)SC1(C)C)c1ccccc1)\[O-]

STK700210
Synonyms: N'-[(1E)-1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]-3-hydroxynaphthalene-2-carbohydrazide
Smiles: Clc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1cc2ccccc2cc1O)/C

STK700211
Synonyms: 8-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SC/C=C(\Cl)/C)nc2c1c(=O)[nH]c(=O)n2C

STK700213
Synonyms: 1,2,3-trichloro-4-(piperidin-1-yl)anthracene-9,10-dione
Smiles: O=C1c2ccccc2C(=O)c2c1c(N1CCCCC1)c(Cl)c(c2Cl)Cl

STK700214
Synonyms: 1-(3-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-(4-nitrophenyl)urea
Smiles: Brc1ccc(c(c1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(cc1)[N+](=O)[O-])O)(C)C)O

STK700215
Synonyms: 4-(6-bromo-2-methyl-4-sulfanylquinolin-3-yl)butan-2-one
Smiles: CC(=O)CCc1c(C)nc2c(c1S)cc(cc2)Br

STK700219
Synonyms: 4-[(Z)-(3,4-dimethoxybenzylidene)(oxido)-lambda~5~-azanyl]-3,5,5-trimethyl-1,3-thiazolidine-2-thione
Smiles: COc1cc(ccc1OC)/C=[N+](/C1N(C)C(=S)SC1(C)C)\[O-]

STK700220
Synonyms: tert-butyl(8R,8aR)-6-amino-8-(5-bromo-2-methoxyphenyl)-5,7,7-tricyano-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(=O)OC(C)(C)C)c1cc(Br)ccc1OC)(C#N)C#N

STK700221
Synonyms: 11-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]undecanoicacid
Smiles: OC(=O)CCCCCCCCCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK700222
Synonyms: N-[2-(diethylamino)ethyl]-N'-(5-propyl-1,3,4-thiadiazol-2-yl)ethanediamide
Smiles: CCCc1nnc(s1)NC(=O)C(=O)NCCN(CC)CC

STK700223
Synonyms: 6-amino-4-[3-(benzyloxy)phenyl]-3-tert-butyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)OCc1ccccc1)c(n[nH]2)C(C)(C)C

STK700224
Synonyms: N'-[(3E)-5-bromo-1-(morpholin-4-ylmethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2-({[(E)-(4-methoxyphenyl)methylidene]amino}oxy)acetohydrazide
Smiles: COc1ccc(cc1)/C=N/OCC(=O)N/N=C\1/C(=O)N(c2c1cc(Br)cc2)CN1CCOCC1

STK700225
Synonyms: (4E)-N-hydroxy-2,6-diphenyl-3-propylpiperidin-4-imine
Smiles: CCCC1/C(=N/O)/CC(NC1c1ccccc1)c1ccccc1

STK700226
Synonyms: 2-({(2E)-3-(4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)ethylacetate
Smiles: CC(=O)OCCNC(=O)/C(=C\c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/NC(=O)c1ccccc1

STK700228
Synonyms: 6-chloro-3-(2-methyl-1,3-thiazol-4-yl)-2H-chromen-2-one
Smiles: Clc1ccc2c(c1)cc(c(=O)o2)c1csc(n1)C

STK700229
Synonyms: 7-(2-chlorobenzyl)-8-(decylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCSc1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C

STK700230
Synonyms: 3-methyl-7-octyl-8-[(2-phenylethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(SCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK700231
Synonyms: 3-(4-chlorophenyl)-1-hydroxy-1-(3-{[(E)-(2-hydroxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)urea
Smiles: Clc1ccc(cc1)NC(=O)N(C1N(/N=C/c2ccccc2O)C(=S)SC1(C)C)O

STK700232
Synonyms: ethyl2-[bis(2-methylpropoxy)phosphoryl]-3,3,3-trifluoro-N-[(4-methylphenyl)sulfonyl]alaninate
Smiles: CCOC(=O)C(P(=O)(OCC(C)C)OCC(C)C)(C(F)(F)F)NS(=O)(=O)c1ccc(cc1)C

STK700234
Synonyms: methyl5-{8,8-dimethyl-5-(morpholin-4-yl)-1-[(phenylcarbonyl)amino]-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridin-2-yl}furan-2-carboxylate
Smiles: COC(=O)c1ccc(o1)c1sc2c(c1NC(=O)c1ccccc1)c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK700235
Synonyms: 3-(4-chlorophenyl)-1-(3-{[(E)-(2-fluorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxyurea
Smiles: Clc1ccc(cc1)NC(=O)N(C1N(/N=C/c2ccccc2F)C(=S)SC1(C)C)O

STK700240
Synonyms: 6-ethyl-6-methyl-2-(methylsulfanyl)-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1)SC

STK700241
Synonyms: 8-[(4-chlorobenzyl)sulfanyl]-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(SCc2ccc(cc2)Cl)nc2c1c(=O)[nH]c(=O)n2C

STK700242
Synonyms: butyl4-{[{[2-(dimethylamino)ethyl]amino}(oxo)acetyl]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=O)C(=O)NCCN(C)C

STK700243
Synonyms: methyl2-{[{[2-(diethylamino)ethyl]amino}(oxo)acetyl]amino}benzoate
Smiles: CCN(CCNC(=O)C(=O)Nc1ccccc1C(=O)OC)CC

STK700244
Synonyms: 4-[bis(5-methylfuran-2-yl)methyl]-N-{(E)-[5-(4-nitrophenyl)furan-2-yl]methylidene}aniline
Smiles: Cc1ccc(o1)C(c1ccc(o1)C)c1ccc(cc1)/N=C/c1ccc(o1)c1ccc(cc1)[N+](=O)[O-]

STK700249
Synonyms: 8-[(3-chloro-2-hydroxypropyl)sulfanyl]-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SCC(CCl)O)nc2c1c(=O)[nH]c(=O)n2C

STK700250
Synonyms: 7-hexyl-3-methyl-8-[(2-oxo-2-phenylethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(SCC(=O)c2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK700251
Synonyms: 7,7-dimethyl-4-phenyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: O=c1c2c3CC(C)(C)OCc3sc2n2c(n1c1ccccc1)nnc2

STK700252
Synonyms: ethyl(2Z)-2-[2-(dibenzo[b,d]furan-2-yl)hydrazinylidene]propanoate
Smiles: CCOC(=O)/C(=N\Nc1ccc2c(c1)c1ccccc1o2)/C

STK700253
Synonyms: 3-(3,4-dichlorophenyl)-1-(5,5-dimethyl-3-{[(E)-pyridin-3-ylmethylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxyurea
Smiles: O=C(N(C1N(/N=C/c2cccnc2)C(=S)SC1(C)C)O)Nc1ccc(c(c1)Cl)Cl

STK700255
Synonyms: 1-(3-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-(4-nitrophenyl)urea
Smiles: O=C(N(C1N(/N=C/c2c(F)cccc2Cl)C(=S)SC1(C)C)O)Nc1ccc(cc1)[N+](=O)[O-]

STK700256
Synonyms: 1-(3,6-dibromo-9H-carbazol-9-yl)-3-[4-(9H-fluoren-9-yl)piperazin-1-yl]propan-2-ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)CN1CCN(CC1)C1c2ccccc2c2c1cccc2

STK700258
Synonyms: 6-bromo-3-{4-[4-(phenylsulfanyl)phenyl]-1,3-thiazol-2-yl}-2H-chromen-2-one
Smiles: Brc1ccc2c(c1)cc(c(=O)o2)c1scc(n1)c1ccc(cc1)Sc1ccccc1

STK700259
Synonyms: (2Z)-1-(2,4-dichlorophenyl)-3-(3-nitrophenyl)-2-(1H-1,2,4-triazol-1-yl)prop-2-en-1-one
Smiles: Clc1ccc(c(c1)Cl)C(=O)/C(=C/c1cccc(c1)[N+](=O)[O-])/n1ncnc1

STK700260
Synonyms: N-(4-amino-9,10-dioxo-9,10-dihydroanthracen-1-yl)benzamide
Smiles: O=C(c1ccccc1)Nc1ccc(c2c1C(=O)c1ccccc1C2=O)N

STK700262
Synonyms: 1-hydroxy-1-(3-{[(E)-(2-hydroxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-phenylurea
Smiles: O=C(N(C1N(/N=C/c2ccccc2O)C(=S)SC1(C)C)O)Nc1ccccc1

STK700263
Synonyms: 5-cyano-N-(2-methoxyphenyl)-2-methyl-4-phenyl-6-(propylsulfanyl)-1,4-dihydropyridine-3-carboxamide
Smiles: CCCSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1OC)c1ccccc1

STK700265
Synonyms: 1-[5,5-dimethyl-3-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)-2-thioxo-1,3-thiazolidin-4-yl]-1-hydroxy-3-methylurea
Smiles: CNC(=O)N(C1N(/N=C/c2ccc(cc2)SC)C(=S)SC1(C)C)O

STK700266
Synonyms: 1-(5,5-dimethyl-3-{[(E)-thiophen-2-ylmethylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-(4-nitrophenyl)urea
Smiles: O=C(N(C1N(/N=C/c2cccs2)C(=S)SC1(C)C)O)Nc1ccc(cc1)[N+](=O)[O-]

STK700268
Synonyms: 2-(2'-oxospiro[1,3-dioxolane-2,3'-indol]-1'(2'H)-yl)acetamide
Smiles: NC(=O)CN1c2ccccc2C2(C1=O)OCCO2

STK700269
Synonyms: 2-[(4-bromophenyl)carbonyl]spiro[2.5]octane-1,1-dicarbonitrile
Smiles: N#CC1(C#N)C(C21CCCCC2)C(=O)c1ccc(cc1)Br

STK700270
Synonyms: 2,2'-[(3,3'-dimethoxybiphenyl-4,4'-diyl)bis(iminomethanediyl)]bis(1H-isoindole-1,3(2H)-dione)
Smiles: COc1cc(ccc1NCN1C(=O)c2c(C1=O)cccc2)c1ccc(c(c1)OC)NCN1C(=O)c2c(C1=O)cccc2

STK700271
Synonyms: 4-[(Z)-(2-fluorobenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-3-phenyl-1,3-thiazolidine-2-thione
Smiles: Fc1ccccc1/C=[N+](/C1N(c2ccccc2)C(=S)SC1(C)C)\[O-]

STK700273
Synonyms: 7-dodecyl-8-[(2-hydroxyethyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SCCO)nc2c1c(=O)[nH]c(=O)n2C

STK700275
Synonyms: 3-methyl-7-nonyl-8-[(2-oxopropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(SCC(=O)C)nc2c1c(=O)[nH]c(=O)n2C

STK700279
Synonyms: 4-{(Z)-[(5,5-dimethyl-3-propyl-2-thioxo-1,3-thiazolidin-4-yl)(oxido)-lambda~5~-azanylidene]methyl}-N-methylbenzenesulfonamide
Smiles: CCCN1C(=S)SC(C1/[N+](=C/c1ccc(cc1)S(=O)(=O)NC)/[O-])(C)C

STK700281
Synonyms: 3-(4-chlorophenyl)-5-(4-methoxyphenyl)-2-(3,4,4-trimethyl-2-thioxo-1,3-thiazolidin-5-yl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1ccc(cc1)Cl)C1SC(=S)N(C1(C)C)C

STK700283
Synonyms: 4-(4-fluorophenyl)-1,3,5-trimethyl-2,6-diphenylpiperidin-4-ol
Smiles: CN1C(c2ccccc2)C(C)C(C(C1c1ccccc1)C)(O)c1ccc(cc1)F

STK700284
Synonyms: 3-amino-5-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cscc1)c1ccccc1cc2O

STK700286
Synonyms: ethyl[(7-dodecyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetate
Smiles: CCCCCCCCCCCCn1c(SCC(=O)OCC)nc2c1c(=O)[nH]c(=O)n2C

STK700287
Synonyms: 1,1'-hexane-1,6-diylbis(1-nitroso-3,3-diphenylurea)
Smiles: O=NN(C(=O)N(c1ccccc1)c1ccccc1)CCCCCCN(C(=O)N(c1ccccc1)c1ccccc1)N=O

STK700288
Synonyms: 5,7-dimethyl-2-(3-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Smiles: [O-][N+](=O)c1cccc(c1)[C@@H]1N2CC3(CN1CC(C2)(C3)C)C

STK700289
Synonyms: 6-chloro-3-{4-[4-(phenylsulfanyl)phenyl]-1,3-thiazol-2-yl}-2H-chromen-2-one
Smiles: Clc1ccc2c(c1)cc(c(=O)o2)c1scc(n1)c1ccc(cc1)Sc1ccccc1

STK700292
Synonyms: 8-{(2E)-2-[(2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]hydrazinyl}-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Br/C(=C\c1ccccc1)/C=N/Nc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STK700293
Synonyms: 4-{[3-({[4-(acetylamino)phenyl]sulfonyl}amino)quinoxalin-2-yl]amino}-2-hydroxybenzoicacid
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccc(c(c1)O)C(=O)O

STK700294
Synonyms: 3-{2-[(2E)-2-benzylidenehydrazinyl]-1,3-thiazol-4-yl}-6-bromo-2H-chromen-2-one
Smiles: Brc1ccc2c(c1)cc(c(=O)o2)c1csc(n1)N/N=C/c1ccccc1

STK700295
Synonyms: 3,6-diamino-N-(4-bromophenyl)-5-cyano-4-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: N#Cc1c(N)nc2c(c1c1cccs1)c(N)c(s2)C(=O)Nc1ccc(cc1)Br

STK700297
Synonyms: 7-dodecyl-3-methyl-8-(octylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SCCCCCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK700298
Synonyms: 7-dodecyl-3-methyl-8-(propan-2-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK700299
Synonyms: N'-dodecanoyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CCCCCCCCCCCC(=O)NNC(=O)c1c(=O)[nH]c2c(c1O)cccc2

STK700300
Synonyms: 2-(butylsulfanyl)-3-(2-methylprop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK700302
Synonyms: 3-methyl-7-(3-methylbutyl)-8-[(3-phenylpropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(SCCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)C

STK700303
Synonyms: 3-{[(6-nitro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl](propan-2-yl)amino}propanenitrile
Smiles: N#CCCN(C(C)C)Cn1c(=O)oc2c1ccc(c2)[N+](=O)[O-]

STK700304
Synonyms: (2Z)-2-[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-3-phenylprop-2-enenitrile
Smiles: N#C/C(=C/c1ccccc1)/c1scc(n1)c1ccc(cc1)Oc1ccccc1

STK700305
Synonyms: N-[(1E)-3-oxo-3-phenylprop-1-en-1-yl]-N-phenylbenzenesulfonamide
Smiles: O=C(c1ccccc1)/C=C/N(S(=O)(=O)c1ccccc1)c1ccccc1

STK700306
Synonyms: N-[(9E)-9-{[4-(4-aminobenzyl)phenyl]imino}-1-hydroxy-10-oxo-9,10-dihydroanthracen-2-yl]benzamide
Smiles: Nc1ccc(cc1)Cc1ccc(cc1)/N=C/1\c2ccccc2C(=O)c2c1c(O)c(cc2)NC(=O)c1ccccc1

STK700308
Synonyms: 3-(3,4-dichlorophenyl)-1-[5,5-dimethyl-3-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)-2-thioxo-1,3-thiazolidin-4-yl]-1-hydroxyurea
Smiles: CSc1ccc(cc1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(c(c1)Cl)Cl)O)(C)C

STK700309
Synonyms: 4-chloro-N-{1-[1-(2-methylphenyl)-1H-tetrazol-5-yl]cyclohexyl}-N-nitrosoaniline
Smiles: O=NN(C1(CCCCC1)c1nnnn1c1ccccc1C)c1ccc(cc1)Cl

STK700310
Synonyms: 7-(2-chlorobenzyl)-3-methyl-8-[(2E)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1Cn1c(N/N=C\2/C(=O)Nc3c2cccc3)nc2c1c(=O)[nH]c(=O)n2C

STK700311
Synonyms: N'-[(3,5-dinitrophenyl)carbonyl]-1-ethyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CCn1c(=O)c(C(=O)NNC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])c(c2c1cccc2)O

STK700312
Synonyms: (2E)-1-[2-(benzyloxy)phenyl]-3-(6-chloro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one
Smiles: Clc1cc(/C=C/C(=O)c2ccccc2OCc2ccccc2)c2c(c1)COCO2

STK700313
Synonyms: 2-(butylsulfanyl)-6-ethyl-6-methyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)CC

STK700314
Synonyms: 2-chloro-3-(pyrrolidin-1-yl)naphthalene-1,4-dione
Smiles: ClC1=C(N2CCCC2)C(=O)c2c(C1=O)cccc2

STK700315
Synonyms: 2-{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]acetamide
Smiles: N#Cc1c(SCC(=O)NC(C23CC4CC(C3)CC(C2)C4)C)nc(cc1C(F)(F)F)C

STK700316
Synonyms: 2-oxo-2H-chromen-7-ylN-[(4-methylphenyl)sulfonyl]valinate
Smiles: CC(C(C(=O)Oc1ccc2c(c1)oc(=O)cc2)NS(=O)(=O)c1ccc(cc1)C)C

STK700317
Synonyms: 2-{4-[chloro(difluoro)methoxy]phenyl}-5-propylpyrimidine
Smiles: CCCc1cnc(nc1)c1ccc(cc1)OC(Cl)(F)F

STK700318
Synonyms: (1S,2S,3aR)-2-(3,5-dimethoxyphenyl)-1-[(4-fluorophenyl)carbonyl]-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Smiles: COc1cc(OC)cc(c1)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H](C1(C#N)C#N)C=Cc1c2cccc1

STK700319
Synonyms: 2-[(6-ethyl-6-methyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1)SCC(=O)N

STK700320
Synonyms: 6-benzyl-3-{(2E)-2-[4-(diethylamino)benzylidene]hydrazinyl}-1,2,4-triazin-5(2H)-one
Smiles: CCN(c1ccc(cc1)/C=N/Nc1[nH]nc(c(=O)n1)Cc1ccccc1)CC

STK700321
Synonyms: 7-dodecyl-3-methyl-8-[(3-methylbutyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SCCC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK700322
Synonyms: N,N,N-trimethyl-3-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)oxy]propan-1-aminium
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)OCCC[N+](C)(C)C

STK700323
Synonyms: 3-butyl-4-[(Z)-(4-hydroxybenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-1,3-thiazolidine-2-thione
Smiles: CCCCN1C(=S)SC(C1/[N+](=C/c1ccc(cc1)O)/[O-])(C)C

STK700325
Synonyms: N'-[(1E)-1-(6,8-dibromo-2-oxo-2H-chromen-3-yl)ethylidene]benzohydrazide
Smiles: Brc1cc(Br)c2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccccc1)/C

STK700326
Synonyms: N-(3-chlorophenyl)-3-methylquinoxalin-2-amine
Smiles: Clc1cccc(c1)Nc1nc2ccccc2nc1C

STK700328
Synonyms: 5,5-dimethyl-4-[(Z)-(4-methylbenzylidene)(oxido)-lambda~5~-azanyl]-3-propyl-1,3-thiazolidine-2-thione
Smiles: CCCN1C(=S)SC(C1/[N+](=C/c1ccc(cc1)C)/[O-])(C)C

STK700329
Synonyms: 3,5,5-trimethyl-4-[(Z)-(4-nitrobenzylidene)(oxido)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione
Smiles: [O-]/[N+](=C\c1ccc(cc1)[N+](=O)[O-])/C1N(C)C(=S)SC1(C)C

STK700330
Synonyms: 11-[(5Z)-5-(4-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]undecanoicacid
Smiles: OC(=O)CCCCCCCCCCN1C(=S)S/C(=C\c2ccc(cc2)Cl)/C1=O

STK700331
Synonyms: 2-(benzylsulfanyl)-5,5-dimethyl-3-(prop-2-en-1-yl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: C=CCn1c(SCc2ccccc2)nc2c(c1=O)C(C)(C)Cc1c2cccc1

STK700332
Synonyms: N,N'-bis(3,5-di-tert-butyl-4-hydroxybenzyl)-N'-phenylpropanehydrazide
Smiles: CCC(=O)N(N(c1ccccc1)Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

STK700334
Synonyms: 3-hydroxy-N'-[(1E)-1-(6-methoxy-2-oxo-2H-chromen-3-yl)ethylidene]naphthalene-2-carbohydrazide
Smiles: COc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1cc2ccccc2cc1O)/C

STK700336
Synonyms: 2-[(2E)-2-(4-bromobenzylidene)-1-methylhydrazinyl]-4-[4-(phenylsulfanyl)phenyl]-1,3-thiazole
Smiles: Brc1ccc(cc1)/C=N/N(c1scc(n1)c1ccc(cc1)Sc1ccccc1)C

STK700338
Synonyms: 3-butyl-1-(3-{[(E)-(2-fluorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxyurea
Smiles: CCCCNC(=O)N(C1N(/N=C/c2ccccc2F)C(=S)SC1(C)C)O

STK700339
Synonyms: N,N-dimethyl-4-{(E)-[(Z)-phenyl(2-phenylhydrazinylidene)methyl]diazenyl}aniline
Smiles: CN(c1ccc(cc1)/N=N/C(=N\Nc1ccccc1)/c1ccccc1)C

STK700340
Synonyms: 6-benzyl-3-[(2E)-2-butylidenehydrazinyl]-1,2,4-triazin-5(2H)-one
Smiles: CCC/C=N/Nc1[nH]nc(c(=O)n1)Cc1ccccc1

STK700341
Synonyms: 1,5-dimethyl-9-oxo-N,N'-diphenyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide
Smiles: S=C(N1CC2(C)CN(CC(C1)(C2=O)C)C(=S)Nc1ccccc1)Nc1ccccc1

STK700342
Synonyms: {[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetonitrile
Smiles: N#CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCC3

STK700343
Synonyms: (8Z)-2-amino-6-ethyl-8-[4-(methylsulfanyl)benzylidene]-4-[4-(methylsulfanyl)phenyl]-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Smiles: CSc1ccc(cc1)/C=C\1/CN(CC)CC2=C1OC(=C(C2c1ccc(cc1)SC)C#N)N

STK700344
Synonyms: 1-(5,5-dimethyl-3-{[(E)-phenylmethylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-(4-nitrophenyl)urea
Smiles: ON(C1N(/N=C/c2ccccc2)C(=S)SC1(C)C)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK700345
Synonyms: 4-[(Z)-(2-chloro-6-fluorobenzylidene)(oxido)-lambda~5~-azanyl]-3,5,5-trimethyl-1,3-thiazolidine-2-thione
Smiles: S=C1SC(C(N1C)/[N+](=C/c1c(F)cccc1Cl)/[O-])(C)C

STK700346
Synonyms: (5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl)aceticacid
Smiles: OC(=O)CC1NC(=S)N(C1=O)c1ccccc1

STK700347
Synonyms: 4-(4-ethoxyphenyl)-2-(hexylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCCCCCSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)OCC

STK700348
Synonyms: 4-hydroxy-2-oxo-N'-tridecanoyl-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CCCCCCCCCCCCC(=O)NNC(=O)c1c(=O)[nH]c2c(c1O)cccc2

STK700349
Synonyms: 2,5-di(morpholin-4-yl)cyclohexa-2,5-diene-1,4-dione
Smiles: O=C1C=C(N2CCOCC2)C(=O)C=C1N1CCOCC1

STK700350
Synonyms: 4-[(Z)-(1H-indol-3-ylmethylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-3-phenyl-1,3-thiazolidine-2-thione
Smiles: S=C1SC(C(N1c1ccccc1)/[N+](=C/c1c[nH]c2c1cccc2)/[O-])(C)C

STK700351
Synonyms: N-[(2E)-2-{[(5-bromofuran-2-yl)carbonyl]amino}-3-(4-bromophenyl)prop-2-enoyl]valine
Smiles: Brc1ccc(cc1)/C=C(\C(=O)NC(C(=O)O)C(C)C)/NC(=O)c1ccc(o1)Br

STK700352
Synonyms: 2-{[(9,10-dioxo-9,10-dihydroanthracen-2-yl)amino]methyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C1c2ccc(cc2C(=O)c2c1cccc2)NCN1C(=O)c2c(C1=O)cccc2

STK700353
Synonyms: 1-(6-methylpyridin-2-yl)pyrrolidine-2,5-dione
Smiles: O=C1CCC(=O)N1c1cccc(n1)C

STK700354
Synonyms: 5,8-dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline1,4-dioxide
Smiles: BrCc1[n+]([O-])c2C(Br)CCC(c2[n+](c1C)[O-])Br

STK700355
Synonyms: 6-{[(2E)-2-{[(5-bromofuran-2-yl)carbonyl]amino}-3-(3-nitrophenyl)prop-2-enoyl]amino}hexanoicacid
Smiles: OC(=O)CCCCCNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccc(o1)Br

STK700356
Synonyms: N-{4-[(1Z)-N-hydroxyethanimidoyl]phenyl}-3,4,5-trimethoxybenzamide
Smiles: O/N=C(\c1ccc(cc1)NC(=O)c1cc(OC)c(c(c1)OC)OC)/C

STK700359
Synonyms: N-{(2E)-3-(3-nitrophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}phenylalanine
Smiles: O=C(/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1)NC(C(=O)O)Cc1ccccc1

STK700360
Synonyms: 8-(2-methoxyphenyl)-9H-benzo[f]indeno[2,1-c]quinolin-9-one
Smiles: COc1ccccc1c1nc2ccc3c(c2c2c1C(=O)c1c2cccc1)cccc3

STK700361
Synonyms: 3,4,4-trimethyl-5-[(E)-oxido(thiophen-2-ylmethylidene)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione
Smiles: [O-]/[N+](=C/c1cccs1)/C1SC(=S)N(C1(C)C)C

STK700363
Synonyms: N-cyclohexyl-3-nitroso-2-oxoimidazolidine-1-carboxamide
Smiles: O=NN1CCN(C1=O)C(=O)NC1CCCCC1

STK700364
Synonyms: N-{(1E)-1-(1,3-benzodioxol-5-yl)-3-[(4-methoxyphenyl)amino]-3-oxoprop-1-en-2-yl}-5-bromofuran-2-carboxamide
Smiles: COc1ccc(cc1)NC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccc(o1)Br

STK700365
Synonyms: 1-hydroxy-1-(3-{[(E)-1H-indol-3-ylmethylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-phenylurea
Smiles: O=C(N(C1N(/N=C/c2c[nH]c3c2cccc3)C(=S)SC1(C)C)O)Nc1ccccc1

STK700366
Synonyms: 3-(3-chlorophenyl)-1-(3-{[(E)-(2-fluorophenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxyurea
Smiles: Clc1cccc(c1)NC(=O)N(C1N(/N=C/c2ccccc2F)C(=S)SC1(C)C)O

STK700367
Synonyms: 2-{4-[4-(phenylsulfanyl)phenyl]-1,3-thiazol-2-yl}-3H-benzo[f]chromen-3-one
Smiles: O=c1oc2ccc3c(c2cc1c1scc(n1)c1ccc(cc1)Sc1ccccc1)cccc3

STK700368
Synonyms: methyl3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCSCC1)cccc2

STK700369
Synonyms: 2-(butylsulfanyl)-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(SC3)(C)C

STK700371
Synonyms: N-[(1E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]-5-bromofuran-2-carboxamide
Smiles: Brc1ccc(o1)C(=O)N/C(=C/c1ccc2c(c1)OCO2)/C(=O)Nc1ccccc1

STK700372
Synonyms: 2-[(7-dodecyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
Smiles: CCCCCCCCCCCCn1c(SCC(=O)N)nc2c1c(=O)[nH]c(=O)n2C

STK700373
Synonyms: (E)-1-(4-nitrophenyl)-2-[(Z)-(4-nitrophenyl)(2-phenylhydrazinylidene)methyl]diazene
Smiles: [O-][N+](=O)c1ccc(cc1)/N=N/C(=N\Nc1ccccc1)/c1ccc(cc1)[N+](=O)[O-]

STK700374
Synonyms: 2-[(2E)-2-(4-chlorobenzylidene)-1-methylhydrazinyl]-4-[4-(phenylsulfanyl)phenyl]-1,3-thiazole
Smiles: Clc1ccc(cc1)/C=N/N(c1scc(n1)c1ccc(cc1)Sc1ccccc1)C

STK700377
Synonyms: 1'-(2-oxo-2-phenylethyl)spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
Smiles: O=C(c1ccccc1)CN1c2ccccc2C2(C1=O)OCCO2

STK700378
Synonyms: 8-bromo-3-{[(E)-(2,4-dichlorophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Clc1ccc(c(c1)Cl)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br

STK700379
Synonyms: ethyl6-amino-5-cyano-2-{[(3-cyano-6-phenylpyridin-2-yl)sulfanyl]methyl}-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(CSc2nc(ccc2C#N)c2ccccc2)OC(=C(C1c1ccc(cc1)OC)C#N)N

STK700381
Synonyms: 8-(trimethylsilyl)-2,3,3a,4,5,6-hexahydro-1H-pyrazino[3,2,1-jk]carbazole
Smiles: C[Si](c1ccc2c(c1)c1CCCC3c1n2CCN3)(C)C

STK700382
Synonyms: 1-[(4-tert-butylphenyl)sulfanyl]-4-(methylamino)anthracene-9,10-dione
Smiles: CNc1ccc(c2c1C(=O)c1ccccc1C2=O)Sc1ccc(cc1)C(C)(C)C

STK700383
Synonyms: 6-amino-4-(4-ethylphenyl)-3-methyl-1-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)CC)c(C)nn2c1ccc(cc1)C

STK700385
Synonyms: 8-bromo-3-methyl-7-(3-{[3-methyl-7-(3-methylbutyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}propyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(SCCCn2c(Br)nc3c2c(=O)[nH]c(=O)n3C)nc2c1c(=O)[nH]c(=O)n2C)C

STK700387
Synonyms: 3-(4-nitrophenyl)-5-phenyl-2-(3,4,4-trimethyl-2-thioxo-1,3-thiazolidin-5-yl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: O=C1N(c2ccccc2)C(=O)C2C1C(c1ccc(cc1)[N+](=O)[O-])N(O2)C1SC(=S)N(C1(C)C)C

STK700392
Synonyms: N-{(2E)-2-{[(5-bromofuran-2-yl)carbonyl]amino}-3-[4-(propan-2-yloxy)phenyl]prop-2-enoyl}-beta-alanine
Smiles: OC(=O)CCNC(=O)/C(=C\c1ccc(cc1)OC(C)C)/NC(=O)c1ccc(o1)Br

STK700394
Synonyms: N-{(2E)-3-(4-bromophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}-beta-alanine
Smiles: OC(=O)CCNC(=O)/C(=C\c1ccc(cc1)Br)/NC(=O)c1ccccc1

STK700395
Synonyms: 1-benzyl-8-[(2-hydroxyethyl)amino]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCNc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1

STK700396
Synonyms: 2-({4-[(5Z)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoicacid
Smiles: O=C(Nc1ccccc1C(=O)O)CCCN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK700397
Synonyms: 4-(4-methylphenyl)-6-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccccc2)NC(=O)CC1c1ccc(cc1)C

STK700398
Synonyms: bis[N,N,N-trimethyl-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanaminium]4,4,5-trimethylcyclopentane-1,3-dicarboxylate
Smiles: CC(C12CC3CC(C2)CC(C1)C3)[N+](C)(C)C.CC(C12CC3CC(C2)CC(C1)C3)[N+](C)(C)C.[O-]C(=O)C1CC(C(C1C)(C)C)C(=O)[O-]

STK700400
Synonyms: (2R,3R,10bS)-2-(3-chlorophenyl)-3-(2,2-dimethylpropanoyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Smiles: N#CC1(C#N)[C@@H](c2cccc(c2)Cl)[C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)C(C)(C)C

STK700401
Synonyms: 3-benzyl-4-[(Z)-(4-hydroxybenzylidene)(oxido)-lambda~5~-azanyl]-5,5-dimethyl-1,3-thiazolidine-2-thione
Smiles: [O-]/[N+](=C\c1ccc(cc1)O)/C1N(Cc2ccccc2)C(=S)SC1(C)C

STK700402
Synonyms: 8-(butylsulfanyl)-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK700403
Synonyms: 4-{[3-({[4-(acetylamino)phenyl]sulfonyl}amino)quinoxalin-2-yl]amino}benzoicacid
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccc(cc1)C(=O)O

STK700404
Synonyms: 2-[(E)-({4-[bis(5-methylfuran-2-yl)methyl]phenyl}imino)methyl]phenol
Smiles: Cc1ccc(o1)C(c1ccc(o1)C)c1ccc(cc1)/N=C/c1ccccc1O

STK700405
Synonyms: 9-(4-chlorobenzyl)-2,3,4,9-tetrahydro-1H-carbazole
Smiles: Clc1ccc(cc1)Cn1c2ccccc2c2c1CCCC2

STK700406
Synonyms: 4-{(2Z)-2-[1-(4-methoxyphenyl)-3-phenylpropylidene]hydrazinyl}-2-methyl-6-phenylpyrimidine
Smiles: COc1ccc(cc1)/C(=N\Nc1nc(C)nc(c1)c1ccccc1)/CCc1ccccc1

STK700407
Synonyms: 3-amino-N,4-bis(2-methoxyphenyl)-6-methyl-2-(phenylcarbonyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxamide
Smiles: COc1ccccc1C1C(=C(C)Nc2c1c(N)c(s2)C(=O)c1ccccc1)C(=O)Nc1ccccc1OC

STK700408
Synonyms: 7-(2-chlorobenzyl)-8-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C

STK700409
Synonyms: 4-{(Z)-[(3-benzyl-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)(oxido)-lambda~5~-azanylidene]methyl}-N-methylbenzenesulfonamide
Smiles: CNS(=O)(=O)c1ccc(cc1)/C=[N+](/C1N(Cc2ccccc2)C(=S)SC1(C)C)\[O-]

STK700410
Synonyms: 5-[2-(4-bromophenyl)-2-oxoethyl]-4,6-dimethyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(=S)[nH]c(c(c1C)CC(=O)c1ccc(cc1)Br)C

STK700412
Synonyms: 3,7-bis(2-chloroethyl)-9,9-dimethyl-1,5-dinitro-3,7-diazabicyclo[3.3.1]nonane
Smiles: ClCCN1CC2(CN(CC(C1)(C2(C)C)[N+](=O)[O-])CCCl)[N+](=O)[O-]

STK700413
Synonyms: (2Z)-2-(heptan-4-ylidenehydrazinylidene)-3-methyl-2,3-dihydro-1,3-benzothiazole
Smiles: CCCC(=N/N=c/1\sc2c(n1C)cccc2)CCC

STK700414
Synonyms: 6,8-dibromo-N-(4-bromophenyl)-2-imino-2H-chromene-3-carboxamide
Smiles: Brc1ccc(cc1)NC(=O)c1cc2cc(Br)cc(c2oc1=N)Br

STK700415
Synonyms: 6,8-dibromo-3-{2-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}-2H-chromen-2-one
Smiles: Brc1ccc(cc1)/C=N/Nc1scc(n1)c1cc2cc(Br)cc(c2oc1=O)Br

STK700416
Synonyms: 3-{2-[(2E)-2-benzylidenehydrazinyl]-1,3-thiazol-4-yl}-6-methoxy-2H-chromen-2-one
Smiles: COc1ccc2c(c1)cc(c(=O)o2)c1csc(n1)N/N=C/c1ccccc1

STK700417
Synonyms: 3,4,4-trimethyl-5-[(E)-(4-methylbenzylidene)(oxido)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione
Smiles: [O-]/[N+](=C/c1ccc(cc1)C)/C1SC(=S)N(C1(C)C)C

STK700419
Synonyms: 2-[(4-tert-butylphenyl)(phenyl)amino]-1-hydroxyanthracene-9,10-dione
Smiles: Oc1c(ccc2c1C(=O)c1ccccc1C2=O)N(c1ccc(cc1)C(C)(C)C)c1ccccc1

STK700420
Synonyms: (2Z)-5-methyl-2-(phenylimino)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazolidine-3-carboxamide
Smiles: CC1S/C(=N\c2ccccc2)/N(C1)C(=O)Nc1cccc(c1)C(F)(F)F

STK700421
Synonyms: 3-benzyl-5,5-dimethyl-4-[(Z)-(3-nitrobenzylidene)(oxido)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione
Smiles: [O-]/[N+](=C\c1cccc(c1)[N+](=O)[O-])/C1N(Cc2ccccc2)C(=S)SC1(C)C

STK700422
Synonyms: 2,6-diphenyl-3-(propan-2-yl)piperidin-4-one
Smiles: CC(C1C(=O)CC(NC1c1ccccc1)c1ccccc1)C

STK700424
Synonyms: N'-[(1E)-1-(6-bromo-2-oxo-2H-chromen-3-yl)ethylidene]-4-nitrobenzohydrazide
Smiles: Brc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccc(cc1)[N+](=O)[O-])/C

STK700425
Synonyms: 8-(4-bromophenoxy)-7-(3-methoxybenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cccc(c1)Cn1c(Oc2ccc(cc2)Br)nc2c1c(=O)n(c(=O)n2C)C

STK700426
Synonyms: 2-(4-bromophenyl)-4,4,7,8-tetramethyl-4,5-dihydro[1,2]thiazolo[5,4-c]quinoline-1(2H)-thione
Smiles: Brc1ccc(cc1)n1sc2c(c1=S)c1cc(C)c(cc1NC2(C)C)C

STK700427
Synonyms: N-[4-(6-methoxy-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]acetamide
Smiles: COc1ccc2c(c1)cc(c(=O)o2)c1csc(n1)NC(=O)C

STK700428
Synonyms: 1,2,5-trimethyl-4-(4-methylphenyl)piperidin-4-ol
Smiles: CN1CC(C)C(CC1C)(O)c1ccc(cc1)C

STK700430
Synonyms: 1-(5,5-dimethyl-3-{[(E)-thiophen-2-ylmethylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-methylurea
Smiles: CNC(=O)N(C1N(/N=C/c2cccs2)C(=S)SC1(C)C)O

STK700431
Synonyms: 6-[(2-hydroxyethyl)amino]-3,3-dimethyl-8-(propan-2-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: OCCNc1nc(C(C)C)c2c(c1C#N)CC(OC2)(C)C

STK700432
Synonyms: 3-benzyl-5,5-dimethyl-4-[(Z)-[4-(methylsulfanyl)benzylidene](oxido)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione
Smiles: CSc1ccc(cc1)/C=[N+](/C1N(Cc2ccccc2)C(=S)SC1(C)C)\[O-]

STK700433
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(2-methylprop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CC(=C)Cn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK700437
Synonyms: 8-bromo-7-(2-chlorobenzyl)-3-methyl-1-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1Cn1c(Br)nc2c1c(=O)n(CCCc1ccccc1)c(=O)n2C

STK700439
Synonyms: 5-[(E)-(4-chlorobenzylidene)(oxido)-lambda~5~-azanyl]-3,4,4-trimethyl-1,3-thiazolidine-2-thione
Smiles: CN1C(=S)SC(C1(C)C)/[N+](=C\c1ccc(cc1)Cl)/[O-]

STK700441
Synonyms: ethyl6-amino-5-cyano-2-{[(5-cyano-2,4'-bipyridin-6-yl)sulfanyl]methyl}-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(CSc2nc(ccc2C#N)c2ccncc2)OC(=C(C1c1ccc(cc1)OC)C#N)N

STK700442
Synonyms: 5-(2-hydroxy-5-nitrophenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Smiles: O=C1CC(C)(C)CC2=C1C(Nc1c2c2ccccc2cc1)c1cc(ccc1O)[N+](=O)[O-]

STK700443
Synonyms: 4-chloro-N'-[(E)-(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]benzohydrazide
Smiles: Clc1ccc(cc1)C(=O)N/N=C/c1cn(nc1c1ccccc1)c1ccccc1

STK700445
Synonyms: 7-(2-chlorobenzyl)-3-methyl-8-(octylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCSc1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C

STK700446
Synonyms: N,N'-[(furan-2-ylmethanediyl)bis(2,6-dimethylbenzene-4,1-diyl)]bis(2,6-difluorobenzamide)
Smiles: Cc1cc(cc(c1NC(=O)c1c(F)cccc1F)C)C(c1cc(C)c(c(c1)C)NC(=O)c1c(F)cccc1F)c1ccco1

STK700447
Synonyms: 2-({3-[butyl(dimethyl)ammonio]propanoyl}amino)-2-methylpropane-1-sulfonate
Smiles: CCCC[N+](CCC(=O)NC(CS(=O)(=O)[O-])(C)C)(C)C

STK700450
Synonyms: 6-ethyl-2-(ethylsulfanyl)-6-methyl-3-(2-methylprop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CC(OC3)(C)CC

STK700453
Synonyms: 1'-(3,3-dimethyl-2-oxobutyl)spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
Smiles: O=C(C(C)(C)C)CN1c2ccccc2C2(C1=O)OCCO2

STK700454
Synonyms: N'-[(1E)-1-(6,8-dibromo-2-oxo-2H-chromen-3-yl)ethylidene]-3-hydroxynaphthalene-2-carbohydrazide
Smiles: Brc1cc(Br)c2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1cc2ccccc2cc1O)/C

STK700456
Synonyms: 1-(4-bromobenzyl)-3,7-dimethyl-8-(3-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)Oc1cccc(c1)C

STK700457
Synonyms: 3-methyl-7-(3-phenylpropyl)-8-[2-(propan-2-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=NNc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C)C

STK700458
Synonyms: 7-dodecyl-3-methyl-8-(prop-2-en-1-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(SCC=C)nc2c1c(=O)[nH]c(=O)n2C

STK700459
Synonyms: N-{(2E)-3-(3-nitrophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}methionine
Smiles: CSCCC(C(=O)O)NC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1

STK700460
Synonyms: 1,1'-{5-[(4-nitrophenyl)carbonyl]-1,3,7-triazabicyclo[3.3.1]nonane-3,7-diyl}diethanone
Smiles: CC(=O)N1CN2CN(CC(C1)(C2)C(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)C

STK700461
Synonyms: (2E)-N-hydroxybenzo[cd]indol-2(1H)-imine
Smiles: O/N=c\1/[nH]c2c3c1cccc3ccc2

STK700462
Synonyms: N-benzyl-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-phenylpropan-1-amine
Smiles: CC1(C)OCCC(C1)C(c1ccccc1)CCNCc1ccccc1

STK700463
Synonyms: phenyl6-bromo-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
Smiles: Brc1ccc2c(c1)oc(=O)n2C(=O)Oc1ccccc1

STK700464
Synonyms: 5-cyano-2-methyl-6-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2)NC(=C(C1c1cccs1)C(=O)N)C

STK700465
Synonyms: N-[(1E)-3-amino-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]-5-bromofuran-2-carboxamide
Smiles: COc1ccc(cc1)/C=C(\C(=O)N)/NC(=O)c1ccc(o1)Br

STK700466
Synonyms: N'-[(1E)-1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]-4-nitrobenzohydrazide
Smiles: Clc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccc(cc1)[N+](=O)[O-])/C

STK700467
Synonyms: 1,1'-(sulfanediyldibenzene-4,1-diyl)bis[3-(1,3-benzothiazol-2-ylsulfanyl)pyrrolidine-2,5-dione]
Smiles: O=C1CC(C(=O)N1c1ccc(cc1)Sc1ccc(cc1)N1C(=O)CC(C1=O)Sc1nc2c(s1)cccc2)Sc1nc2c(s1)cccc2

STK700468
Synonyms: 8-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)/C=N/Nc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STK700469
Synonyms: ethyl2-[(3,4-dichlorophenyl)amino]-3,3,3-trifluoro-N-[(4-methoxyphenyl)carbonyl]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1)OC)Nc1ccc(c(c1)Cl)Cl

STK700472
Synonyms: [(4-amino-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]aceticacid
Smiles: OC(=O)CSc1nc(N)c2c(n1)sc1c2CC(OC1)(C)C

STK700473
Synonyms: 1-hydroxy-1-(3-{[(E)-(2-hydroxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-methylurea
Smiles: CNC(=O)N(C1N(/N=C/c2ccccc2O)C(=S)SC1(C)C)O

STK700474
Synonyms: 2-{[6,6-dimethyl-4-oxo-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)N)nc2c(c1=O)c1CC(C)(C)SCc1s2

STK700475
Synonyms: 7-hexyl-3-methyl-8-[(2-oxobutyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(SCC(=O)CC)nc2c1c(=O)[nH]c(=O)n2C

STK700477
Synonyms: benzylN-{(2E)-3-(4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}alaninate
Smiles: O=C(C(NC(=O)/C(=C\c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/NC(=O)c1ccccc1)C)OCc1ccccc1

STK700478
Synonyms: 4-(2-methoxyphenyl)-1,3,5-trimethyl-2,6-diphenylpiperidin-4-ol
Smiles: COc1ccccc1C1(O)C(C)C(c2ccccc2)N(C(C1C)c1ccccc1)C

STK700479
Synonyms: 6-methyl-2-(pyridin-4-yl)-1H-indole
Smiles: Cc1ccc2c(c1)[nH]c(c2)c1ccncc1

STK700480
Synonyms: 6,8-dibromo-N-(4-chlorophenyl)-2-imino-2H-chromene-3-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc2cc(Br)cc(c2oc1=N)Br

STK700481
Synonyms: N-(4-methoxyphenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
Smiles: COc1ccc(cc1)Nc1ncnc2c1c(C)c(s2)C

STK700482
Synonyms: 5,5-dimethyl-4-[(Z)-(3-nitrobenzylidene)(oxido)-lambda~5~-azanyl]-3-propyl-1,3-thiazolidine-2-thione
Smiles: CCCN1C(=S)SC(C1/[N+](=C/c1cccc(c1)[N+](=O)[O-])/[O-])(C)C

STK700484
Synonyms: 5-[(Z)-(2-chloro-6-fluorobenzylidene)(oxido)-lambda~5~-azanyl]-3,4,4-trimethyl-1,3-thiazolidine-2-thione
Smiles: S=C1SC(C(N1C)(C)C)/[N+](=C/c1c(F)cccc1Cl)/[O-]

STK700485
Synonyms: 2-[4-(heptyloxy)phenyl]-5-octylpyrimidine
Smiles: CCCCCCCCc1cnc(nc1)c1ccc(cc1)OCCCCCCC

STK700487
Synonyms: 6,8-dibromo-3-{2-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}-2H-chromen-2-one
Smiles: Clc1ccc(cc1)/C=N/Nc1scc(n1)c1cc2cc(Br)cc(c2oc1=O)Br

STK700490
Synonyms: (5Z)-3-(4-methylphenyl)-2-phenyl-5-[4-(propan-2-yloxy)benzylidene]-3,5-dihydro-4H-imidazol-4-one
Smiles: CC(Oc1ccc(cc1)/C=C/1\N=C(N(C1=O)c1ccc(cc1)C)c1ccccc1)C

STK700492
Synonyms: 4-(thiophen-2-yl)-2,3-dihydro-1H-benzo[f]cyclopenta[c]quinoline
Smiles: C1Cc2c(C1)c1c(nc2c2cccs2)ccc2c1cccc2

STK700493
Synonyms: 3-{2-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}-6-chloro-2H-chromen-2-one
Smiles: Brc1ccc(cc1)/C=N/Nc1scc(n1)c1cc2cc(Cl)ccc2oc1=O

STK700494
Synonyms: 4-[2-amino-3-(ethoxycarbonyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl]benzoicacid
Smiles: CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C(=O)O

STK700495
Synonyms: N'-[(1E)-1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]benzohydrazide
Smiles: Clc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccccc1)/C

STK700497
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Clc1ccc(cc1)C(=O)CSc1[nH]c(=O)c2c(n1)c1ccccc1CC12CCCCC1

STK700498
Synonyms: 2-[(2E)-2-(4-methoxybenzylidene)-1-methylhydrazinyl]-4-(4-phenoxyphenyl)-1,3-thiazole
Smiles: COc1ccc(cc1)/C=N/N(c1scc(n1)c1ccc(cc1)Oc1ccccc1)C

STK700499
Synonyms: butyl4-{[{[3-(dimethylamino)propyl]amino}(oxo)acetyl]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=O)C(=O)NCCCN(C)C

STK700501
Synonyms: benzyl4-({(2E)-3-(4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)butanoate
Smiles: O=C(OCc1ccccc1)CCCNC(=O)/C(=C\c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/NC(=O)c1ccccc1

STK700502
Synonyms: 2-chloro-3-[(4-nitrobenzyl)oxy]-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Smiles: Clc1cc2c(cc1OCc1ccc(cc1)[N+](=O)[O-])oc(=O)c1c2CCCC1

STK700503
Synonyms: N-[(1E)-3-(benzylamino)-1-(4-bromophenyl)-3-oxoprop-1-en-2-yl]-5-bromofuran-2-carboxamide
Smiles: Brc1ccc(cc1)/C=C(\C(=O)NCc1ccccc1)/NC(=O)c1ccc(o1)Br

STK700504
Synonyms: 6,8-dibromo-3-{4-[4-(phenylsulfanyl)phenyl]-1,3-thiazol-2-yl}-2H-chromen-2-one
Smiles: Brc1cc(Br)c2c(c1)cc(c(=O)o2)c1scc(n1)c1ccc(cc1)Sc1ccccc1

STK700505
Synonyms: 7-hexyl-8-[(2-hydroxyethyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(SCCO)nc2c1c(=O)[nH]c(=O)n2C

STK700506
Synonyms: 4-(2-amino-3-cyano-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoicacid
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C(=O)O

STK700507
Synonyms: phenyl6-chloro-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
Smiles: Clc1ccc2c(c1)oc(=O)n2C(=O)Oc1ccccc1

STK700508
Synonyms: 6-chloro-4-methyl-2-oxo-2H-chromen-7-ylN-[(benzyloxy)carbonyl]valinate
Smiles: O=C(NC(C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)C)C(C)C)OCc1ccccc1

STK700513
Synonyms: 1-(2-hydroxyethyl)-3-(2-{[(2-hydroxyethyl)carbamoyl](nitroso)amino}ethyl)-1-nitrosourea(non-preferredname)
Smiles: OCCNC(=O)N(CCNC(=O)N(CCO)N=O)N=O

STK700514
Synonyms: methyl5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-(2-iodophenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: CCOC(=O)CSC1=C(C#N)C(C(C(=O)N1)C(=O)OC)c1ccccc1I

STK700518
Synonyms: 5-[4-(dimethylamino)phenyl]-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Smiles: CN(c1ccc(cc1)C1Nc2ccc3c(c2C2=C1C(=O)CCC2)cccc3)C

STK700522
Synonyms: 5-bromo-N-[(1E)-1-(4-bromophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]furan-2-carboxamide
Smiles: Brc1ccc(cc1)/C=C(\C(=O)Nc1ccccc1)/NC(=O)c1ccc(o1)Br

STK700523
Synonyms: N'-{(E)-[5-(4-methylphenyl)furan-2-yl]methylidene}-4-nitrobenzohydrazide
Smiles: Cc1ccc(cc1)c1ccc(o1)/C=N/NC(=O)c1ccc(cc1)[N+](=O)[O-]

STK700524
Synonyms: 3-[4-(9H-fluoren-2-yl)-1,3-thiazol-2-yl]-6-hexyl-7-hydroxy-2H-chromen-2-one
Smiles: CCCCCCc1cc2cc(c3scc(n3)c3ccc4c(c3)Cc3c4cccc3)c(=O)oc2cc1O

STK700525
Synonyms: 6-chloro-3-{2-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}-2H-chromen-2-one
Smiles: Clc1ccc(cc1)/C=N/Nc1scc(n1)c1cc2cc(Cl)ccc2oc1=O

STK700526
Synonyms: 1-hydroxy-1-(3-{[(E)-(4-hydroxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)-3-(4-nitrophenyl)urea
Smiles: Oc1ccc(cc1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(cc1)[N+](=O)[O-])O)(C)C

STK700527
Synonyms: 3-{[(2-chlorophenyl)amino]methyl}-6-nitro-1,3-benzoxazol-2(3H)-one
Smiles: Clc1ccccc1NCn1c(=O)oc2c1ccc(c2)[N+](=O)[O-]

STK700528
Synonyms: N-methyl-4-{(Z)-[oxido(3,5,5-trimethyl-2-thioxo-1,3-thiazolidin-4-yl)-lambda~5~-azanylidene]methyl}benzenesulfonamide
Smiles: CNS(=O)(=O)c1ccc(cc1)/C=[N+](/C1N(C)C(=S)SC1(C)C)\[O-]

STK700529
Synonyms: 1-[3-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl]-1-hydroxy-3-(4-nitrophenyl)urea
Smiles: CN(c1ccc(cc1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(cc1)[N+](=O)[O-])O)(C)C)C

STK700530
Synonyms: N-[4-chloro-3-(2,5-dioxopyrrolidin-1-yl)phenyl]-1-hydroxynaphthalene-2-carboxamide
Smiles: O=C(c1ccc2c(c1O)cccc2)Nc1ccc(c(c1)N1C(=O)CCC1=O)Cl

STK700531
Synonyms: 3-[(3-{[(4-bromophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoicacid
Smiles: Brc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1cccc(c1)C(=O)O

STK700532
Synonyms: 3-[2-amino-3-(ethoxycarbonyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl]benzoicacid
Smiles: CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C(=O)O

STK700533
Synonyms: 6-(4-butanoylpiperazin-1-yl)-3,3-dimethyl-8-(propan-2-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: CCCC(=O)N1CCN(CC1)c1nc(C(C)C)c2c(c1C#N)CC(OC2)(C)C

STK700534
Synonyms: 2-amino-1-(4-iodophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)I

STK700535
Synonyms: 3-benzyl-5,5-dimethyl-4-[(Z)-(4-nitrobenzylidene)(oxido)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione
Smiles: S=C1SC(C(N1Cc1ccccc1)/[N+](=C/c1ccc(cc1)[N+](=O)[O-])/[O-])(C)C

STK700536
Synonyms: ethyl(8R,8aR)-6-amino-5,7,7-tricyano-8-(2-methoxyphenyl)-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccccc1OC)C(C(=C2C#N)N)(C#N)C#N

STK700537
Synonyms: 3-butyl-1-hydroxy-1-(3-{[(E)-(2-methoxyphenyl)methylidene]amino}-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl)urea
Smiles: CCCCNC(=O)N(C1N(/N=C/c2ccccc2OC)C(=S)SC1(C)C)O

STK700539
Synonyms: 2-amino-4-(2-methoxyphenyl)-7,7-dimethyl-3-nitro-4,6,7,8-tetrahydro-5H-chromen-5-one
Smiles: COc1ccccc1C1C2=C(OC(=C1[N+](=O)[O-])N)CC(CC2=O)(C)C

STK700541
Synonyms: {[5,5-dimethyl-4-oxo-3-(prop-2-en-1-yl)-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl]sulfanyl}acetonitrile
Smiles: C=CCn1c(SCC#N)nc2c(c1=O)C(C)(C)Cc1c2cccc1

STK700543
Synonyms: N-[(E)-{2-[(5-tert-butyl-2-hydroxy-3-methylphenyl)carbonyl]hydrazinyl}(phenyl)methylidene]benzenesulfonamide
Smiles: O=C(c1cc(cc(c1O)C)C(C)(C)C)NN/C(=N/S(=O)(=O)c1ccccc1)/c1ccccc1

STK700546
Synonyms: 3-benzyl-4-[(Z)-[4-(dimethylamino)benzylidene](oxido)-lambda~5~-azanyl]-5,5-dimethyl-1,3-thiazolidine-2-thione
Smiles: CN(c1ccc(cc1)/C=[N+](/C1N(Cc2ccccc2)C(=S)SC1(C)C)\[O-])C

STK700548
Synonyms: 2-[(2E)-2-(4-chlorobenzylidene)-1-methylhydrazinyl]-4-(4-phenoxyphenyl)-1,3-thiazole
Smiles: Clc1ccc(cc1)/C=N/N(c1scc(n1)c1ccc(cc1)Oc1ccccc1)C

STK700550
Synonyms: N-{1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]cyclopentyl}-N-nitrosoaniline
Smiles: O=NN(C1(CCCC1)c1nnnn1c1c(C)cccc1C)c1ccccc1

STK700551
Synonyms: 1-ethyl-4-hydroxy-2-oxo-N'-tetradecanoyl-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CCCCCCCCCCCCCC(=O)NNC(=O)c1c(O)c2ccccc2n(c1=O)CC

STK700555
Synonyms: N'-[(E)-(4-cyanophenyl)methylidene]pyridine-2-carbohydrazide
Smiles: N#Cc1ccc(cc1)/C=N/NC(=O)c1ccccn1

STK700556
Synonyms: 1-(5-bromothiophen-2-yl)-2-{3-[2-(diethylamino)ethyl]-2-imino-2,3-dihydro-1H-benzimidazol-1-yl}ethanone
Smiles: CCN(CCn1c(=N)n(c2c1cccc2)CC(=O)c1ccc(s1)Br)CC

STK700557
Synonyms: N-[2-(2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-1-yl)ethyl]-2-methylpropan-2-amine
Smiles: CC(NCCN1CCn2c1nc1c2cccc1)(C)C

STK700558
Synonyms: 2,6-di-tert-butyl-4-[(E)-{[1-(4-chlorobenzyl)-1H-benzimidazol-2-yl]imino}methyl]phenol
Smiles: Clc1ccc(cc1)Cn1c(/N=C/c2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)nc2c1cccc2

STK700560
Synonyms: 2-[3-(2-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzimidazol-1-yl]-1-(3,5-di-tert-butyl-4-hydroxyphenyl)ethanone
Smiles: O=C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)Cn1c(=N)n(c2c1cccc2)Cc1ccccc1Cl

STK700564
Synonyms: 2-[2-(biphenyl-4-yl)-9H-imidazo[1,2-a]benzimidazol-9-yl]-N,N-dimethylethanamine
Smiles: CN(CCn1c2nc(cn2c2c1cccc2)c1ccc(cc1)c1ccccc1)C

STK700565
Synonyms: 2-(2-imino-3-methyl-2,3-dihydro-1H-benzimidazol-1-yl)-1-(thiophen-2-yl)ethanone
Smiles: O=C(c1cccs1)Cn1c(=N)n(c2c1cccc2)C

STK700566
Synonyms: N-[(E)-(4-methoxyphenyl)methylidene]-1-[2-(piperidin-1-yl)ethyl]-1H-benzimidazol-2-amine
Smiles: COc1ccc(cc1)/C=N/c1nc2c(n1CCN1CCCCC1)cccc2

STK700568
Synonyms: 2-(4-bromophenyl)-1-(2-chloroethyl)-1H-imidazo[1,2-a]benzimidazole
Smiles: ClCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)Br

STK700569
Synonyms: 2-tert-butyl-1-(3-chloropropyl)-1H-imidazo[1,2-a]benzimidazole
Smiles: ClCCCn1c2nc3c(n2cc1C(C)(C)C)cccc3

STK700570
Synonyms: methyl4-{(E)-[1-(4-nitrophenyl)-5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C\1/C(=O)N(N=C1c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK700571
Synonyms: 1-[3-(2-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzimidazol-1-yl]-3,3-dimethylbutan-2-one
Smiles: O=C(C(C)(C)C)Cn1c(=N)n(c2c1cccc2)Cc1ccccc1Cl

STK700572
Synonyms: 2-(3-butyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)-1-(3,5-di-tert-butyl-4-hydroxyphenyl)ethanone
Smiles: CCCCn1c(=N)n(c2c1cccc2)CC(=O)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

STK700574
Synonyms: 1-(4-chlorobenzyl)-N-[(E)-(5-nitrofuran-2-yl)methylidene]-1H-benzimidazol-2-amine
Smiles: Clc1ccc(cc1)Cn1c(/N=C/c2ccc(o2)[N+](=O)[O-])nc2c1cccc2

STK700575
Synonyms: 2-(3,4-dihydropyrimido[1,2-a]benzimidazol-10(2H)-yl)-1-(naphthalen-1-yl)ethanone
Smiles: O=C(c1cccc2c1cccc2)Cn1c2=NCCCn2c2c1cccc2

STK700578
Synonyms: 1-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole
Smiles: O1CCN(CC1)CCN1CCn2c1nc1c2cccc1

STK700579
Synonyms: N-[2-(2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-1-yl)ethyl]cyclohexanamine
Smiles: C1CCC(CC1)NCCN1CCn2c1nc1c2cccc1

STK700580
Synonyms: 1-(4-heptylphenyl)-2-{2-[(2-hydroxyethyl)amino]-1H-benzimidazol-1-yl}ethanone
Smiles: CCCCCCCc1ccc(cc1)C(=O)Cn1c(NCCO)nc2c1cccc2

STK700581
Synonyms: N-[(E)-(4,8-dimethoxynaphthalen-1-yl)methylidene]-1-[2-(piperidin-1-yl)ethyl]-1H-benzimidazol-2-amine
Smiles: COc1ccc(c2c1cccc2OC)/C=N/c1nc2c(n1CCN1CCCCC1)cccc2

STK700582
Synonyms: 1-butyl-N-[(E)-(3,4-dimethoxyphenyl)methylidene]-1H-benzimidazol-2-amine
Smiles: CCCCn1c(/N=C/c2ccc(c(c2)OC)OC)nc2c1cccc2

STK700583
Synonyms: 2-(4-chlorophenyl)-1-(3-chloropropyl)-1H-imidazo[1,2-a]benzimidazole
Smiles: ClCCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)Cl

STK700585
Synonyms: 9-hexyl-2,9-dihydro-3H-imidazo[1,2-a]benzimidazole
Smiles: CCCCCCn1c2=NCCn2c2c1cccc2

STK700586
Synonyms: 4-[(Z)-(5-oxo-3-phenyl-1,2-oxazol-4(5H)-ylidene)methyl]phenylbenzenesulfonate
Smiles: O=C1ON=C(/C/1=C/c1ccc(cc1)OS(=O)(=O)c1ccccc1)c1ccccc1

STK700587
Synonyms: N-[(E)-1,3-benzodioxol-5-ylmethylidene]-1-(4-tert-butylbenzyl)-1H-benzimidazol-2-amine
Smiles: CC(c1ccc(cc1)Cn1c(/N=C/c2ccc3c(c2)OCO3)nc2c1cccc2)(C)C

STK700589
Synonyms: N-[(E)-(4,8-dimethoxynaphthalen-1-yl)methylidene]-1-[2-(morpholin-4-yl)ethyl]-1H-benzimidazol-2-amine
Smiles: COc1ccc(c2c1cccc2OC)/C=N/c1nc2c(n1CCN1CCOCC1)cccc2

STK700591
Synonyms: (morpholin-4-ylmethyl)[(2-oxoazepan-1-yl)methyl]phosphinicacid
Smiles: O=C1CCCCCN1CP(=O)(CN1CCOCC1)O

STK700592
Synonyms: 4-methoxy-N-{(E)-[4-(2-methylphenyl)-2-(thiophen-2-yl)-4H-chromen-3-yl]methylidene}aniline
Smiles: COc1ccc(cc1)/N=C/C1=C(Oc2c(C1c1ccccc1C)cccc2)c1cccs1

STK700593
Synonyms: 6-ethyl-6-methyl-3-(2-methylprop-2-en-1-yl)-2-(methylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=O)CC(=C)C)SC

STK700594
Synonyms: N'-{(E)-[2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methylidene}pyridine-4-carbohydrazide
Smiles: CCOc1ccc(cc1)C1=C(/C=N/NC(=O)c2ccncc2)C(c2c(O1)cccc2)c1ccc(cc1)F

STK700595
Synonyms: N'-{(E)-[4-(4-methylphenyl)-2-(thiophen-2-yl)-4H-chromen-3-yl]methylidene}-5-nitrofuran-2-carbohydrazide
Smiles: Cc1ccc(cc1)C1C(=C(Oc2c1cccc2)c1cccs1)/C=N/NC(=O)c1ccc(o1)[N+](=O)[O-]

STK700596
Synonyms: N-{(E)-[2-(3,4-dimethoxyphenyl)-4-(2-methylphenyl)-4H-chromen-3-yl]methylidene}aniline
Smiles: COc1cc(ccc1OC)C1=C(/C=N/c2ccccc2)C(c2c(O1)cccc2)c1ccccc1C

STK700598
Synonyms: [2-(6-methylpyridin-3-yl)ethyl](piperidin-1-ylmethyl)phosphinicacid
Smiles: Cc1ccc(cn1)CCP(=O)(CN1CCCCC1)O

STK700599
Synonyms: 2-(1H-indol-3-yl)-N-{(E)-[4-(2-methylphenyl)-2-(thiophen-2-yl)-4H-chromen-3-yl]methylidene}ethanamine
Smiles: Cc1ccccc1C1C(=C(Oc2c1cccc2)c1cccs1)/C=N/CCc1c[nH]c2c1cccc2

STK700600
Synonyms: 2-(1H-indol-3-yl)-N-{(E)-[4-(4-methylphenyl)-2-(thiophen-2-yl)-4H-chromen-3-yl]methylidene}ethanamine
Smiles: Cc1ccc(cc1)C1C(=C(Oc2c1cccc2)c1cccs1)/C=N/CCc1c[nH]c2c1cccc2

STK700601
Synonyms: N-{1-[(2,6-dimethylphenyl)carbamoyl]cyclopentyl}-N-(3-methylphenyl)pyridine-2-carboxamide
Smiles: Cc1cccc(c1)N(C1(CCCC1)C(=O)Nc1c(C)cccc1C)C(=O)c1ccccn1

STK700602
Synonyms: N-(3-chlorophenyl)-1-{[(2,4-dichlorophenoxy)acetyl]amino}-4-methylcyclohexanecarboxamide
Smiles: CC1CCC(CC1)(NC(=O)COc1ccc(cc1Cl)Cl)C(=O)Nc1cccc(c1)Cl

STK700603
Synonyms: ethyl2-[(4-tert-butylbenzyl)sulfanyl]-3-cyano-5,6,7,8-tetrahydroquinoline-4-carboxylate
Smiles: CCOC(=O)c1c(C#N)c(SCc2ccc(cc2)C(C)(C)C)nc2c1CCCC2

STK700604
Synonyms: N'-{(E)-[2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methylidene}-5-nitrofuran-2-carbohydrazide
Smiles: CCOc1ccc(cc1)C1=C(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])C(c2c(O1)cccc2)c1ccc(cc1)F

STK700607
Synonyms: 3-amino-N,N-diethyl-6-methyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: CCN(C(=O)c1sc2c(c1N)c(cc(n2)C)C(F)(F)F)CC

STK700608
Synonyms: N-{1-[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]-2-methylcyclohexyl}-4-methylaniline
Smiles: COc1ccc(cc1)n1nnnc1C1(CCCCC1C)Nc1ccc(cc1)C

STK700610
Synonyms: 4-iodo-N-{1-[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]cyclohexyl}aniline
Smiles: COc1ccc(cc1)n1nnnc1C1(CCCCC1)Nc1ccc(cc1)I

STK700611
Synonyms: (8R,8aR)-6-amino-2-benzyl-8-(5-bromo-2-fluorophenyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)Cc1ccccc1)c1cc(Br)ccc1F)(C#N)C#N

STK700612
Synonyms: 6-amino-8-(4-chlorophenyl)-2-propyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: CCCN1CC=C2C(C1)C(c1ccc(cc1)Cl)C(C(=C2C#N)N)(C#N)C#N

STK700613
Synonyms: 1-[2-(dodecanoyloxy)-3-(2-oxopyrrolidin-1-yl)propyl]piperidinium
Smiles: CCCCCCCCCCCC(=O)OC(CN1CCCC1=O)C[NH+]1CCCCC1

STK700614
Synonyms: 2-methoxy-N-{(E)-[4-(2-methylphenyl)-2-(thiophen-2-yl)-4H-chromen-3-yl]methylidene}aniline
Smiles: COc1ccccc1/N=C/C1=C(Oc2c(C1c1ccccc1C)cccc2)c1cccs1

STK700615
Synonyms: N-[4-({(E)-[2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methylidene}amino)phenyl]acetamide
Smiles: CCOc1ccc(cc1)C1=C(/C=N/c2ccc(cc2)NC(=O)C)C(c2c(O1)cccc2)c1ccc(cc1)F

STK700616
Synonyms: 2-{hydroxy[(2-oxopyrrolidin-1-yl)methyl]phosphoryl}-3-phenylpropanoicacid
Smiles: OC(=O)C(P(=O)(CN1CCCC1=O)O)Cc1ccccc1

STK700617
Synonyms: N-(3-chlorophenyl)-2-{[(2,4-dichlorophenoxy)acetyl]amino}-2-phenylacetamide
Smiles: O=C(NC(C(=O)Nc1cccc(c1)Cl)c1ccccc1)COc1ccc(cc1Cl)Cl

STK700619
Synonyms: 2-methoxy-N-{(E)-[4-(4-methylphenyl)-2-(thiophen-2-yl)-4H-chromen-3-yl]methylidene}aniline
Smiles: COc1ccccc1/N=C/C1=C(Oc2c(C1c1ccc(cc1)C)cccc2)c1cccs1

STK700620
Synonyms: ethyl2-amino-4-(2,4-dichlorophenyl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccc(cc1Cl)Cl)c(=O)oc1c2cccc1

STK700621
Synonyms: 1-ethyl-3,5-dimethyl-1H-[1,2,4]triazepino[4,3-a]benzimidazole
Smiles: CCn1nc(C)cc(n2c1nc1c2cccc1)C

STK700623
Synonyms: dibutyl(morpholin-4-ylmethyl)phosphonate
Smiles: CCCCOP(=O)(CN1CCOCC1)OCCCC

STK700624
Synonyms: N'-{(E)-[4-(2-methylphenyl)-2-phenyl-4H-chromen-3-yl]methylidene}-5-nitrofuran-2-carbohydrazide
Smiles: O=C(c1ccc(o1)[N+](=O)[O-])N/N=C/C1=C(Oc2c(C1c1ccccc1C)cccc2)c1ccccc1

STK700625
Synonyms: 6-amino-4-(3-bromophenyl)-3-(methoxymethyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: COCc1n[nH]c2c1C(c1cccc(c1)Br)C(=C(O2)N)C#N

STK700626
Synonyms: (8S)-6-amino-8-(3,4-dimethoxyphenyl)-2-(propan-2-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H](C2C1=CCN(C2)C(C)C)c1ccc(c(c1)OC)OC)(C#N)C#N