FULL DB

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

STK549479
Synonyms: N-butyl-2-(pyridin-4-yl)quinazolin-4-amine
Smiles: CCCCNc1nc(nc2c1cccc2)c1ccncc1

STK843865
Synonyms: dimethyl5-{[(Z)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino}benzene-1,3-dicarboxylate
Smiles: N#C/C(=C/Nc1cc(cc(c1)C(=O)OC)C(=O)OC)/c1scc(n1)c1ccccc1

STK549481
Synonyms: 3-bromo-2-oxo-N-(3-oxo-1,3-dihydro-2-benzofuran-5-yl)-2H-pyran-5-carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)Nc1ccc2c(c1)C(=O)OC2

STK549482
Synonyms: 2-(1H-indol-2-yl)-N'-[(2E)-4-methyl-4-(5-methylfuran-2-yl)pentan-2-ylidene]acetohydrazide
Smiles: Cc1ccc(o1)C(C/C(=N/NC(=O)Cc1cc2c([nH]1)cccc2)/C)(C)C

STK843866
Synonyms: 2-(2,6-dimethylmorpholin-4-yl)-N-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine
Smiles: CC1OC(C)CN(C1)c1nc(Nc2cccc(c2)C)c(c(n1)N)[N+](=O)[O-]

STK549485
Synonyms: 5-[3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-(pyridin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1cccnc1)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

STK549490
Synonyms: (5Z)-5-(2,3-dimethoxybenzylidene)-3-(2,3-dimethylphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)c1cccc(c1C)C

STK549502
Synonyms: (4bR,7aS,8R)-6-(1,3-benzodioxol-5-yl)-8-[(4-methoxyphenyl)carbonyl]-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc2c(c1)OCO2

STK843871
Synonyms: 4-({(Z)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzamide
Smiles: N#C/C(=C/Nc1ccc(cc1)C(=O)N)/c1scc(n1)c1ccc(cc1)Cl

STK549504
Synonyms: (5Z)-2-[(2-bromophenyl)amino]-5-(3-ethoxy-4-hydroxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=NC1=O)Nc1ccccc1Br

STK549505
Synonyms: 4-[5-(3,4-dimethoxyphenyl)-1',3'-diphenyl-3,4-dihydro-1'H,2H-3,4'-bipyrazol-2-yl]-4-oxobutanoicacid
Smiles: COc1cc(ccc1OC)C1=NN(C(C1)c1cn(nc1c1ccccc1)c1ccccc1)C(=O)CCC(=O)O

STK843872
Synonyms: (2Z)-[2-(4-methoxyphenyl)hydrazinylidene]{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)OC)/c1scc(n1)c1ccc(cc1)CC(C)C

STK549511
Synonyms: benzyl5-cyano-6-({2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2c(C)cccc2C)NC(=C(C1c1ccco1)C(=O)OCc1ccccc1)C

STK549514
Synonyms: 5-[5-(furan-2-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1ccco1)c1ccc(cc1)C

STK843874
Synonyms: 3-(1,3-benzothiazol-2-yl)-2-oxo-2H-chromen-7-yl4-chlorobutanoate
Smiles: ClCCCC(=O)Oc1ccc2c(c1)oc(=O)c(c2)c1nc2c(s1)cccc2

STK549516
Synonyms: 4-[5-(2-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccccc1F)c1cccs1

STK549518
Synonyms: 2-methoxyethyl6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-(4-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)NCc1ccccc1

STK549519
Synonyms: 1-phenyl-1H-tetrazol-5-yl(1E)-N-(4-nitrophenyl)-2-oxopropanehydrazonothioate
Smiles: CC(=O)/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/Sc1nnnn1c1ccccc1

STK549523
Synonyms: 2-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-phenylpropanoicacid
Smiles: COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)Cc1ccccc1

STK549525
Synonyms: ethyl6-ethyl-7-hydroxy-3-(1-methyl-1H-benzimidazol-2-yl)-8-[(2-methylpiperidin-1-yl)methyl]-4-oxo-4H-chromene-2-carboxylate
Smiles: CCOC(=O)c1oc2c(CN3CCCCC3C)c(O)c(cc2c(=O)c1c1nc2c(n1C)cccc2)CC

STK549529
Synonyms: 2-{[3-(3-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK549532
Synonyms: (5Z)-2-[(2-chlorophenyl)amino]-5-(2,5-dimethoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1ccc(c(c1)/C=C/1\SC(=NC1=O)Nc1ccccc1Cl)OC

STK549534
Synonyms: N-(4-chlorophenyl)-5-nitro-2-(pyrrolidin-1-yl)pyrimidine-4,6-diamine
Smiles: Clc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCCC1

STK549537
Synonyms: 8-chloro-10-(4-methylphenyl)pyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
Smiles: Cc1ccc(cc1)n1c2cc(Cl)ccc2cc2c1nc(=O)[nH]c2=O

STK549539
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1Cn1nc(c(c1C)Br)C)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N

STK843881
Synonyms: N-(4-bromophenyl)-2-{2-[(4-hydroxyphenyl)(methyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamide
Smiles: O=C(CC1SC(=NC1=O)N(c1ccc(cc1)O)C)Nc1ccc(cc1)Br

STK843883
Synonyms: 2-[3-(9H-carbazol-9-yl)-2-hydroxypropoxy]-N-phenylbenzamide
Smiles: OC(Cn1c2ccccc2c2c1cccc2)COc1ccccc1C(=O)Nc1ccccc1

STK549543
Synonyms: 2-({[(4-tert-butylbenzyl)oxy]carbonyl}amino)-4,5-dimethoxybenzoicacid
Smiles: COc1cc(NC(=O)OCc2ccc(cc2)C(C)(C)C)c(cc1OC)C(=O)O

STK549545
Synonyms: 2-[(4-tert-butylphenoxy)methyl]-1-(2-methoxybenzyl)-1H-benzimidazole
Smiles: COc1ccccc1Cn1c(COc2ccc(cc2)C(C)(C)C)nc2c1cccc2

STK549548
Synonyms: (4-methoxyphenyl)[3-(piperidin-1-yl)quinoxalin-2-yl]acetonitrile
Smiles: N#CC(c1nc2ccccc2nc1N1CCCCC1)c1ccc(cc1)OC

STK549550
Synonyms: 1-(4-butylphenyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccc(cc1)C

STK549552
Synonyms: N-(4-chlorophenyl)-2-(3-methylpiperidin-1-yl)-5-nitropyrimidine-4,6-diamine
Smiles: CC1CCCN(C1)c1nc(Nc2ccc(cc2)Cl)c(c(n1)N)[N+](=O)[O-]

STK843886
Synonyms: ethylN-{[2-methyl-5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)phenyl]sulfonyl}glycinate
Smiles: CCOC(=O)CNS(=O)(=O)c1cc(ccc1C)c1nn(C)c(=O)c2c1cccc2

STK549557
Synonyms: 4-(4-chloro-3,5-dimethylphenoxy)-2-(pyridin-2-yl)quinazoline
Smiles: Clc1c(C)cc(cc1C)Oc1nc(nc2c1cccc2)c1ccccn1

STK549560
Synonyms: N-(furan-2-ylmethyl)-6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: CSc1nc(NCc2ccco2)c2c(n1)sc1c2CC(OC1)(C)C

STK843887
Synonyms: (5Z)-5-(2-methoxybenzylidene)-3-(3-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cccc(c1)N1C(=S)S/C(=C\c2ccccc2OC)/C1=O

STK843888
Synonyms: (2Z)-3-[(2,4-difluorophenyl)amino]-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1F)F)/c1scc(n1)c1ccc(c(c1)OC)OC

STK549561
Synonyms: 2-(2,6-dimethylmorpholin-4-yl)-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CC(C)OC(C1)C)c([nH]2)C

STK549567
Synonyms: ethyl4-{[(3-bromo-2,8-dimethyl-4-oxoquinolin-1(4H)-yl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)Cn1c(C)c(Br)c(=O)c2c1c(C)ccc2

STK549577
Synonyms: (5Z)-2-[(3-chlorophenyl)amino]-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4(5H)-one
Smiles: Clc1cccc(c1)NC1=NC(=O)/C(=C/c2cccs2)/S1

STK549579
Synonyms: ethyl5-cyano-6-({2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(2-fluorophenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=C(C1c1ccccc1F)C#N)SCC(=O)Nc1c(C)cccc1C

STK549584
Synonyms: 1-(4-bromophenyl)-3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]pyrrolidine-2,5-dione
Smiles: Brc1ccc(cc1)N1C(=O)CC(C1=O)Cn1nc(cc1C)C

STK549586
Synonyms: 4-{(Z)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}phenylacetate
Smiles: N#C/C(=C/c1ccc(cc1)OC(=O)C)/c1scc(n1)c1cccc(c1)Br

STK843899
Synonyms: (2Z)-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl][2-(4-ethylphenyl)hydrazinylidene]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)CC)/c1scc(n1)c1ccc2c(c1)OCO2

STK549590
Synonyms: N~4~-(4-chlorophenyl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4,6-triamine
Smiles: Clc1ccc(cc1)Nc1nc(NCCCN2CCOCC2)nc(c1[N+](=O)[O-])N

STK843902
Synonyms: 4-{(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}phenylacetate
Smiles: N#C/C(=C/c1ccc(cc1)OC(=O)C)/c1scc(n1)c1ccc2c(c1)OCO2

STK549594
Synonyms: (5Z)-2-[(2,3-dichlorophenyl)amino]-5-(2,3-dimethoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1c(cccc1OC)/C=C/1\SC(=NC1=O)Nc1cccc(c1Cl)Cl

STK549598
Synonyms: 3-[1-acetyl-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-5-yl]-7-ethoxyquinolin-2(1H)-one
Smiles: CCOc1ccc2c(c1)[nH]c(=O)c(c2)C1CC(=NN1C(=O)C)c1ccco1

STK843904
Synonyms: [4-(diphenylmethyl)piperazin-1-yl](piperidin-1-yl)methanone
Smiles: O=C(N1CCCCC1)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK843905
Synonyms: (2E)-3-[(4-fluoro-2-nitrophenyl)amino]-2-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1[N+](=O)[O-])F)/c1scc(n1)c1cccc2c1cccc2

STK549611
Synonyms: 1-(dibenzylamino)-3-(4-methoxyphenoxy)propan-2-ol
Smiles: COc1ccc(cc1)OCC(CN(Cc1ccccc1)Cc1ccccc1)O

STK549613
Synonyms: [3-amino-4,6-dimethyl-5-(prop-2-en-1-yl)thieno[2,3-b]pyridin-2-yl](4-bromophenyl)methanone
Smiles: C=CCc1c(C)nc2c(c1C)c(N)c(s2)C(=O)c1ccc(cc1)Br

STK549618
Synonyms: 7-(4-fluorophenyl)-3-(4-nitrophenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: Fc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1ccc(cc1)[N+](=O)[O-]

STK801748
Synonyms: N-(4-methoxyphenyl)-N-(oxiran-2-ylmethyl)benzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccccc1)CC1OC1

STK549631
Synonyms: ethyl6-amino-5-cyano-2-methyl-4-[2-(piperidin-1-yl)quinolin-3-yl]-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1cc2ccccc2nc1N1CCCCC1)C#N)N

STK549633
Synonyms: 2-{4-[cyclohexyl(methyl)amino]quinazolin-2-yl}-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(N(C2CCCCC2)C)c2c(n1)cccc2

STK549635
Synonyms: 12-(propan-2-yl)-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
Smiles: CC(C1OCc2c(C1)c1c3nncn3c3n(c1s2)cnn3)C

STK549640
Synonyms: (8R,8aS,11aR)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1[C@H]2C(=O)NC(=O)[C@H]2C2N1N=Cc1c2cccc1

STK843914
Synonyms: (5Z)-5-(4-hydroxy-3-methoxybenzylidene)-2-[(2-methylphenyl)amino]-1,3-thiazol-4(5H)-one
Smiles: COc1cc(ccc1O)/C=C/1\SC(=NC1=O)Nc1ccccc1C

STK549641
Synonyms: 4-[4-(2-phenylpropan-2-yl)phenoxy]-2-(pyridin-4-yl)quinazoline
Smiles: CC(c1ccccc1)(c1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccncc1)C

STK549643
Synonyms: ethyl1-ethyl-6,7-difluoro-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylate
Smiles: CCOC(=O)c1c(O)c2cc(F)c(cc2n(c1=O)CC)F

STK843915
Synonyms: 4-(3,5-dimethylphenoxy)-2-(2-fluorophenyl)quinazoline
Smiles: Cc1cc(C)cc(c1)Oc1nc(nc2c1cccc2)c1ccccc1F

STK549649
Synonyms: N-(3-{[2-(pyridin-2-yl)quinazolin-4-yl]oxy}phenyl)acetamide
Smiles: CC(=O)Nc1cccc(c1)Oc1nc(nc2c1cccc2)c1ccccn1

STK843918
Synonyms: 4-{(Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}-2,6-dimethoxyphenylacetate
Smiles: N#C/C(=C/c1cc(OC)c(c(c1)OC)OC(=O)C)/c1scc(n1)c1ccc(cc1)Br

STK843919
Synonyms: 1-(9H-carbazol-9-yl)-3-[2-(cyclohex-3-en-1-yl)-1H-benzimidazol-1-yl]propan-2-ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)Cn1c(nc2c1cccc2)C1CCC=CC1

STK549659
Synonyms: N-(1-phenylethyl)-2-(pyridin-4-yl)quinazolin-4-amine
Smiles: CC(c1ccccc1)Nc1nc(nc2c1cccc2)c1ccncc1

STK549660
Synonyms: 1-(dibenzylamino)-3-(2-methylphenoxy)propan-2-ol
Smiles: OC(CN(Cc1ccccc1)Cc1ccccc1)COc1ccccc1C

STK549664
Synonyms: 6-(4-chlorophenyl)-2-phenyl-4,5-dihydropyridazine-3(2H)-thione
Smiles: Clc1ccc(cc1)C1=NN(C(=S)CC1)c1ccccc1

STK549666
Synonyms: (2E)-3-[(3,4-difluorophenyl)amino]-2-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)F)F)/c1scc(n1)c1cccc2c1cccc2

STK549668
Synonyms: N-[(5Z)-5-(2,5-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-4-nitrobenzamide
Smiles: COc1ccc(cc1/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)[N+](=O)[O-])OC

STK549669
Synonyms: 1-(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-2-(4-ethylpiperazin-1-yl)ethanone
Smiles: CCN1CCN(CC1)CC(=O)c1c2cc(OC)ccc2n(c1C)Cc1ccccc1

STK549671
Synonyms: (3aR,4S,8aR,8bS)-2-(naphthalen-2-yl)-4-(phenylcarbonyl)hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione
Smiles: O=C([C@H]1N2CCC[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)cccc2)c1ccccc1

STK549672
Synonyms: (5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-2-[(3-methylphenyl)amino]-1,3-thiazol-4(5H)-one
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=NC1=O)Nc1cccc(c1)C

STK549676
Synonyms: N-(2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-L-leucine
Smiles: CC(C[C@@H](C(=O)O)Nc1nc(C)nc2c1c1CCCCc1s2)C

STK843921
Synonyms: 5-[(3-bromo-4-methoxybenzyl)sulfanyl]-2-methyl-4-nitro-1H-imidazole
Smiles: COc1ccc(cc1Br)CSc1[nH]c(nc1[N+](=O)[O-])C

STK549677
Synonyms: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-6-propyl-4H-chromen-7-yl2-chlorobenzoate
Smiles: CCCc1cc2c(cc1OC(=O)c1ccccc1Cl)occ(c2=O)c1ccc2c(c1)OCCO2

STK549682
Synonyms: (5Z)-5-(2,3-dimethoxybenzylidene)-3-(3-hydroxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)c1cccc(c1)O

STK549687
Synonyms: (2Z)-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl][2-(4-bromophenyl)hydrazinylidene]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)Br)/c1scc(n1)c1ccc2c(c1)OCO2

STK549692
Synonyms: 3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1-(4-ethylphenyl)pyrrolidine-2,5-dione
Smiles: CCc1ccc(cc1)N1C(=O)CC(C1=O)Cn1nc(cc1C)C

STK549693
Synonyms: (5Z)-2-[(2-bromophenyl)amino]-5-(3-fluorobenzylidene)-1,3-thiazol-4(5H)-one
Smiles: Fc1cccc(c1)/C=C/1\SC(=NC1=O)Nc1ccccc1Br

STK549698
Synonyms: 4-chloro-N-[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]benzenesulfonamide
Smiles: CC1CCCN(C1)c1nc2ccccc2nc1NS(=O)(=O)c1ccc(cc1)Cl

STK549704
Synonyms: N-[2-(naphthalen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide
Smiles: CC(=O)Nc1c(nc2n1cccc2)c1ccc2c(c1)cccc2

STK843928
Synonyms: (5Z)-5-(2-methoxybenzylidene)-2-[(4-methylphenyl)amino]-1,3-thiazol-4(5H)-one
Smiles: COc1ccccc1/C=C/1\SC(=NC1=O)Nc1ccc(cc1)C

STK549716
Synonyms: 2,4-dichloro-N-[(5Z)-5-(2-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: COc1ccccc1/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1Cl)Cl

STK549719
Synonyms: 2-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoicacid
Smiles: COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)C

STK549721
Synonyms: (5Z)-2-[(2-chlorophenyl)amino]-5-(2-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1ccccc1/C=C/1\SC(=NC1=O)Nc1ccccc1Cl

STK549730
Synonyms: methyl4-({[(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nncc2c1c(OC)c(cc2)OC

STK549731
Synonyms: (5Z)-5-(2,5-dimethoxybenzylidene)-2-[(4-methylphenyl)amino]-1,3-thiazol-4(5H)-one
Smiles: COc1ccc(cc1/C=C/1\SC(=NC1=O)Nc1ccc(cc1)C)OC

STK843933
Synonyms: 7-(2-ethoxyethyl)-3-methyl-8-[(2-phenylethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCOCCn1c(SCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK549738
Synonyms: 2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxy-4-(4-methylpiperazin-1-yl)quinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCN(CC1)C)c1ccc(c(c1)OC)OC

STK549740
Synonyms: 7,8-dimethoxy-4-(4-phenylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole
Smiles: COc1cc2c(cc1OC)[nH]c1c2ncnc1N1CCN(CC1)c1ccccc1

STK549742
Synonyms: 4-(4-fluorophenoxy)-2-(pyridin-2-yl)quinazoline
Smiles: Fc1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccccn1

STK549743
Synonyms: (3aR,4S,8aR,8bS)-2-(3-bromophenyl)-4-(phenylcarbonyl)hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione
Smiles: Brc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2CCC1)C(=O)c1ccccc1

STK843938
Synonyms: [4-(4-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl](2-methylpiperidin-1-yl)methanone
Smiles: Clc1ccc(cc1)C1Nc2ccc(cc2C2C1CC=C2)C(=O)N1CCCCC1C

STK549748
Synonyms: (5E)-1-cyclohexyl-5-(1-{[2-(pyridin-3-yl)piperidin-1-yl]amino}ethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: C/C(=C\1/C(=O)NC(=S)N(C1=O)C1CCCCC1)/NN1CCCCC1c1cccnc1

STK843939
Synonyms: 2-(4-benzylpiperazin-1-yl)-N-(4-methoxyphenyl)-5-nitropyrimidine-4,6-diamine
Smiles: COc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCN(CC1)Cc1ccccc1

STK549750
Synonyms: N-[3-(azepan-1-yl)quinoxalin-2-yl]-4-chlorobenzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1N1CCCCCC1

STK843940
Synonyms: 5-(3,4-dimethoxyphenyl)-N-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Smiles: CNC(=S)N1N=C(CC1c1ccc(c(c1)OC)OC)c1ccccc1

STK843941
Synonyms: 1-benzyl-7,7-dimethyl-2-phenyl-1,5,7,8-tetrahydro-4H-pyrano[4,3-d]pyrimidine-4-thione
Smiles: S=c1nc(c2ccccc2)n(c2c1COC(C2)(C)C)Cc1ccccc1

STK549753
Synonyms: N~2~-(3-methylphenyl)-N~4~-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: Cc1ccc(cc1)Nc1nc(Nc2cccc(c2)C)nc(c1[N+](=O)[O-])N

STK549764
Synonyms: 2-[(2-methoxyphenyl)imino]-5-nitrodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccccc1/N=C/1\NC(=O)C(C(=O)N1)[N+](=O)[O-]

STK843942
Synonyms: 2-chloro-7-ethoxy-3-[3-(furan-2-yl)-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazol-5-yl]quinoline
Smiles: CCOc1ccc2c(c1)nc(c(c2)C1CC(=NN1S(=O)(=O)C)c1ccco1)Cl

STK843943
Synonyms: (2Z)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-[(3,4-difluorophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(c(c1)F)F)/c1scc(n1)c1cccc(c1)Br

STK549771
Synonyms: ethyl2-({(E)-2-cyano-2-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C(/c2scc(n2)c2cccc3c2cccc3)\C#N)sc2c1CCCC2

STK549773
Synonyms: N~2~-(3-chlorophenyl)-N~4~-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: Cc1ccc(cc1)Nc1nc(Nc2cccc(c2)Cl)nc(c1[N+](=O)[O-])N

STK549774
Synonyms: 6-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoicacid
Smiles: COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)CCCCCC(=O)O

STK549776
Synonyms: 1-(morpholin-4-yl)-2-[(3-phenylnaphthalen-1-yl)oxy]propan-1-one
Smiles: O=C(C(Oc1cc(cc2c1cccc2)c1ccccc1)C)N1CCOCC1

STK549785
Synonyms: N-(4-acetylphenyl)-1-amino-5-(morpholin-4-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)Nc1ccc(cc1)C(=O)C

STK549786
Synonyms: 1-(dimethylamino)propan-2-yl1,3-benzodioxole-5-carboxylate
Smiles: CN(CC(OC(=O)c1ccc2c(c1)OCO2)C)C

STK549789
Synonyms: 3-bromo-5-(morpholin-4-ylcarbonyl)-2H-pyran-2-one
Smiles: O=C(c1coc(=O)c(c1)Br)N1CCOCC1

STK843946
Synonyms: 2-[4-(4-phenylpiperazin-1-yl)quinazolin-2-yl]phenol
Smiles: Oc1ccccc1c1nc2ccccc2c(n1)N1CCN(CC1)c1ccccc1

STK843948
Synonyms: ethyl6-amino-5-cyano-4-(furan-2-yl)-2-propyl-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(CCC)OC(=C(C1c1ccco1)C#N)N

STK549791
Synonyms: 2-[4-(cyclohexylamino)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(NC2CCCCC2)c2c(n1)cccc2

STK549792
Synonyms: 2-amino-9-(2,5-dimethoxyphenyl)-4-methyl-7-oxo-6,7,8,9-tetrahydrothieno[2,3-b:4,5-b']dipyridine-3-carbonitrile
Smiles: COc1ccc(cc1C1CC(=O)Nc2c1c1nc(N)c(c(c1s2)C)C#N)OC

STK549793
Synonyms: N-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-L-valine
Smiles: CCc1sc2c(c1)c(ncn2)N[C@H](C(=O)O)C(C)C

STK843950
Synonyms: (5Z)-3-[4-(diethylamino)phenyl]-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCN(c1ccc(cc1)N1C(=S)S/C(=C\c2cccs2)/C1=O)CC

STK549796
Synonyms: (9E)-3-(4-bromophenyl)-9-(4-methoxybenzylidene)-5-(4-methoxyphenyl)-7-methyl-6,7,8,9-tetrahydro-5H-pyrido[4,3-d][1,3]thiazolo[3,2-a]pyrimidine
Smiles: COc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Br)/C(=C/c1ccc(cc1)OC)/CN(C2)C

STK549797
Synonyms: 2-(ethylsulfanyl)-6-propyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCC

STK549800
Synonyms: benzyl5-cyano-6-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)F)NC(=C(C1c1ccco1)C(=O)OCc1ccccc1)C

STK549804
Synonyms: 2-fluoro-N-[(1E)-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxo-1-(pyridin-3-yl)prop-1-en-2-yl]benzamide
Smiles: O=C(/C(=C\c1cccnc1)/NC(=O)c1ccccc1F)NCCc1c[nH]c2c1cccc2

STK549812
Synonyms: (5Z)-3-(4-methylphenyl)-5-[4-(prop-2-en-1-yloxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)C

STK549815
Synonyms: 8-butyl-1-methyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCCCn1c(cn2c1nc1c2c(=O)[nH]c(=O)n1C)c1ccccc1

STK549816
Synonyms: azepan-1-yl[4-(2,4-dichlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]methanone
Smiles: Clc1ccc(c(c1)Cl)C1Nc2ccc(cc2C2C1CC=C2)C(=O)N1CCCCCC1

STK549817
Synonyms: N~4~-(4-chlorophenyl)-N~2~-methyl-5-nitropyrimidine-2,4,6-triamine
Smiles: CNc1nc(Nc2ccc(cc2)Cl)c(c(n1)N)[N+](=O)[O-]

STK549819
Synonyms: 2-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]butanoicacid
Smiles: CCC(N1C(=S)S/C(=C\c2cccs2)/C1=O)C(=O)O

STK549822
Synonyms: 9-(4-fluorophenyl)-3-methyl-1-phenyl-1H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidine-5,7(6H,9H)-dione
Smiles: Fc1ccc(cc1)n1c2nc(=O)[nH]c(=O)c2cc2c1n(nc2C)c1ccccc1

STK549823
Synonyms: N-(3-fluorophenyl)-2-[4-(propan-2-yloxy)phenyl]quinazolin-4-amine
Smiles: CC(Oc1ccc(cc1)c1nc(Nc2cccc(c2)F)c2c(n1)cccc2)C

STK549825
Synonyms: methyl3-[(4-amino-6,8-diphenyl-5,8-dihydro-6H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoate
Smiles: COC(=O)CCSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1

STK549830
Synonyms: N~2~-benzyl-N~4~-(4-methoxyphenyl)-N~2~-methyl-5-nitropyrimidine-2,4,6-triamine
Smiles: COc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N(Cc1ccccc1)C

STK549831
Synonyms: 3-bromo-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-oxo-2H-pyran-5-carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)Nc1c(C)n(n(c1=O)c1ccccc1)C

STK843957
Synonyms: 4-{(Z)-2-cyano-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl}-2,6-dimethoxyphenylacetate
Smiles: N#C/C(=C/c1cc(OC)c(c(c1)OC)OC(=O)C)/c1scc(n1)c1ccc(cc1Cl)Cl

STK843958
Synonyms: 2-({4-amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}amino)ethanol
Smiles: OCCNc1nc(Nc2ccc(cc2)C)c(c(n1)N)[N+](=O)[O-]

STK549833
Synonyms: prop-2-en-1-yl2-amino-1-(3,4-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)C)C

STK549834
Synonyms: 3-methyl-2-{(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoicacid
Smiles: CC(C(N1C(=S)S/C(=C\C(=C\c2ccccc2)\C)/C1=O)C(=O)O)C

STK549836
Synonyms: {(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}(phenyl)aceticacid
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)C(=O)O

STK549837
Synonyms: ethyl5-cyano-4-(2-fluorophenyl)-2-oxo-6-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=C(C1c1ccccc1F)C#N)SCC(=O)Nc1ccccc1

STK843961
Synonyms: 4-(azepan-1-yl)-2-(2-fluorophenyl)quinazoline
Smiles: Fc1ccccc1c1nc(N2CCCCCC2)c2c(n1)cccc2

STK843963
Synonyms: N~2~-methyl-N~4~-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: CNc1nc(Nc2ccc(cc2)C)c(c(n1)N)[N+](=O)[O-]

STK549842
Synonyms: 6-hydroxy-3-(4-methylphenyl)-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione
Smiles: Cc1ccc(cc1)n1c(=O)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK549844
Synonyms: (3,5-dinitrophenyl)[2-(4-methylphenyl)-1,3-thiazolidin-3-yl]methanone
Smiles: Cc1ccc(cc1)C1SCCN1C(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

STK549845
Synonyms:
Smiles: C[C@H]([C@@H](C(=O)O)Nc1ncnc2c1c1CCCc1s2)O

STK549846
Synonyms: 4-{(Z)-2-cyano-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]ethenyl}-2,6-dimethoxyphenylacetate
Smiles: N#C/C(=C/c1cc(OC)c(c(c1)OC)OC(=O)C)/c1scc(n1)c1cccc(c1)OC

STK549848
Synonyms: 4-oxo-4-(1',3',5-triphenyl-3,4-dihydro-1'H,2H-3,4'-bipyrazol-2-yl)butanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cn(nc1c1ccccc1)c1ccccc1)c1ccccc1

STK549849
Synonyms: 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)C(=O)c1ccco1)c([nH]2)C

STK843966
Synonyms: N-[(E)-(2,5-dimethoxyphenyl)methylidene]-4-(2-methoxyphenyl)piperazin-1-amine
Smiles: COc1ccc(c(c1)/C=N/N1CCN(CC1)c1ccccc1OC)OC

STK549853
Synonyms: 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-[(E)-furan-2-ylmethylidene]acetohydrazide
Smiles: O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)N/N=C/c1ccco1

STK549854
Synonyms: 4-chloro-N-(12-cyanoindolizino[2,3-b]quinoxalin-3-yl)benzamide
Smiles: N#Cc1c2ccc(cn2c2c1nc1ccccc1n2)NC(=O)c1ccc(cc1)Cl

STK549859
Synonyms: 4-[(2E)-2-(3,4-dimethoxybenzylidene)hydrazinyl]-2-[4-(propan-2-yloxy)phenyl]quinazoline
Smiles: COc1cc(/C=N/Nc2nc(nc3c2cccc3)c2ccc(cc2)OC(C)C)ccc1OC

STK843967
Synonyms: (2Z)-3-[(3-acetylphenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1)C(=O)C)/c1scc(n1)c1ccc(cc1)CC(C)C

STK549864
Synonyms: 2-(4-butoxyphenyl)-4-(ethylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCC)c2c(n1)sc1c2CC(OC1)(C)C

STK843969
Synonyms: 6-iodo-3-(2-methylprop-2-en-1-yl)-2-(propan-2-ylsulfanyl)quinazolin-4(3H)-one
Smiles: CC(=C)Cn1c(SC(C)C)nc2c(c1=O)cc(cc2)I

STK549866
Synonyms: 3-[(1,3-benzodioxol-5-ylmethyl)amino]-5-(4-methoxyphenyl)cyclohex-2-en-1-one
Smiles: COc1ccc(cc1)C1CC(=CC(=O)C1)NCc1ccc2c(c1)OCO2

STK549868
Synonyms: N-benzyl-2-(4-benzylpiperidin-1-yl)-5-nitropyrimidine-4,6-diamine
Smiles: [O-][N+](=O)c1c(N)nc(nc1NCc1ccccc1)N1CCC(CC1)Cc1ccccc1

STK843973
Synonyms: (2E)-2-(4-phenyl-1,3-thiazol-2-yl)-3-{[2-(trifluoromethyl)phenyl]amino}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1C(F)(F)F)/c1scc(n1)c1ccccc1

STK549871
Synonyms: 2-(4-benzylpiperidin-1-yl)-N-(4-methoxyphenyl)-5-nitropyrimidine-4,6-diamine
Smiles: COc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCC(CC1)Cc1ccccc1

STK549873
Synonyms: methyl(2Z)-3,4-dihydroquinolin-1(2H)-yl(2-phenylhydrazinylidene)ethanoate
Smiles: COC(=O)/C(=N/Nc1ccccc1)/N1CCCc2c1cccc2

STK549874
Synonyms: dipropan-2-yl{hydroxy[2-(trifluoromethyl)phenyl]methyl}phosphonate
Smiles: CC(OP(=O)(C(c1ccccc1C(F)(F)F)O)OC(C)C)C

STK843974
Synonyms: (2Z)-[2-(4-methylphenyl)hydrazinylidene][4-(naphthalen-2-yl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)C)/c1scc(n1)c1ccc2c(c1)cccc2

STK549878
Synonyms: N-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-2-hydroxybenzamide
Smiles: COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccccc1O

STK549880
Synonyms: 3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-oxo-2H-chromen-7-yl4-methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1ccc2c(c1)oc(=O)c(c2)c1scc(n1)c1ccc(cc1)Br

STK549881
Synonyms: N-tert-butyl-2-{[3-cyano-4-(3,5-dibromo-4-hydroxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)NC(C)(C)C)NC(=O)CC1c1cc(Br)c(c(c1)Br)O

STK549885
Synonyms: 6,6-dimethyl-4-[(2-methylprop-2-en-1-yl)sulfanyl]-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CSc1nc(SCC(=C)C)c2c(n1)sc1c2CC(OC1)(C)C

STK549888
Synonyms: cyclohexyl(phenyl)[3-(piperidin-1-yl)propyl]silanol
Smiles: O[Si](c1ccccc1)(C1CCCCC1)CCCN1CCCCC1

STK549889
Synonyms: 5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-6-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1F)C

STK843978
Synonyms: 3,3'-[biphenyl-4,4'-diylbis(oxy)]bis[1-(morpholin-4-yl)propan-2-ol]
Smiles: OC(CN1CCOCC1)COc1ccc(cc1)c1ccc(cc1)OCC(CN1CCOCC1)O

STK549897
Synonyms: 4-[(5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoicacid
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)C(=O)O

STK843979
Synonyms: (2E)-3-[(4-fluoro-2-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1[N+](=O)[O-])F)/c1scc(n1)c1ccc(cc1)CC(C)C

STK843982
Synonyms: 4-bromo-2-[(2E)-3-(2-methoxyphenyl)prop-2-enoyl]phenylmorpholine-4-carboxylate
Smiles: COc1ccccc1/C=C/C(=O)c1cc(Br)ccc1OC(=O)N1CCOCC1

STK549902
Synonyms: [1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl](4-fluorophenyl)methanone
Smiles: CCOc1cc(ccc1OCC)CC1N(CCc2c1cc(OCC)c(c2)OCC)C(=O)c1ccc(cc1)F

STK843983
Synonyms: 2-[4-(azepan-1-yl)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc2ccccc2c(n1)N1CCCCCC1

STK549904
Synonyms: 2-methoxyethyl4-(2-chlorophenyl)-5-cyano-6-({2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1c(C)cccc1C

STK843984
Synonyms: 4-(4-fluorophenyl)-2,2,5-trimethyl-2,5-dihydro-1H-imidazol-1-ol3-oxide
Smiles: CC1N(O)C([N+](=C1c1ccc(cc1)F)[O-])(C)C

STK549908
Synonyms: 5-cyano-4-(4-ethoxyphenyl)-6-({2-[(2-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2ccccc2CC)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK549913
Synonyms: {[2-(4-butoxyphenyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}aceticacid
Smiles: CCCCOc1ccc(cc1)c1nc(SCC(=O)O)c2c(n1)sc1c2CC(OC1)(C)C

STK549916
Synonyms: (5Z)-2-[(2-bromophenyl)amino]-5-(2-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1ccccc1/C=C/1\SC(=NC1=O)Nc1ccccc1Br

STK549919
Synonyms: 4-chloro-2-[(3-{[(4-chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoicacid
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1cc(Cl)ccc1C(=O)O

STK843985
Synonyms: N-(ethoxymethyl)-N-(2-ethyl-6-methylphenyl)-2-{2-[(4-methoxyphenoxy)methyl]-1H-benzimidazol-1-yl}acetamide
Smiles: CCOCN(c1c(C)cccc1CC)C(=O)Cn1c(COc2ccc(cc2)OC)nc2c1cccc2

STK549924
Synonyms: 2-{(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoicacid
Smiles: CC(N1C(=S)S/C(=C\C(=C\c2ccccc2)\C)/C1=O)C(=O)O

STK549929
Synonyms: 1-[9'-bromo-2'-(pyridin-3-yl)-1',10b'-dihydro-1H-spiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-1-yl]ethanone
Smiles: Brc1ccc2c(c1)C1CC(=NN1C1(O2)CCN(CC1)C(=O)C)c1cccnc1

STK549930
Synonyms: N-(4-methoxyphenyl)-2-(pyridin-2-yl)quinazolin-4-amine
Smiles: COc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccccn1

STK549931
Synonyms: N-(4-methylphenyl)-2-(morpholin-4-yl)-5-nitropyrimidine-4,6-diamine
Smiles: Cc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCOCC1

STK843986
Synonyms: N-(2-methoxyethyl)-2-methyl-5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide
Smiles: COCCNS(=O)(=O)c1cc(ccc1C)c1nn(C)c(=O)c2c1cccc2

STK549936
Synonyms: N~4~-(2-fluorophenyl)-5-nitro-N~2~-(2-phenylethyl)pyrimidine-2,4,6-triamine
Smiles: [O-][N+](=O)c1c(N)nc(nc1Nc1ccccc1F)NCCc1ccccc1

STK549944
Synonyms: N~4~-(4-methylphenyl)-5-nitro-N~2~-(2-phenylethyl)pyrimidine-2,4,6-triamine
Smiles: Cc1ccc(cc1)Nc1nc(NCCc2ccccc2)nc(c1[N+](=O)[O-])N

STK549953
Synonyms: 5,6-di(furan-2-yl)-3-(propylsulfanyl)-1,2,4-triazine
Smiles: CCCSc1nnc(c(n1)c1ccco1)c1ccco1

STK843989
Synonyms: 1-{2-[(4,6-dimethoxypyrimidin-2-yl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone
Smiles: COc1nc(Nc2sc(c(n2)C)C(=O)C)nc(c1)OC

STK549959
Synonyms: 2-[4-(dipropylamino)quinazolin-2-yl]phenol
Smiles: CCCN(c1nc(nc2c1cccc2)c1ccccc1O)CCC

STK549962
Synonyms: 3-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-8-nitro-2H-chromen-2-one
Smiles: Cc1ccc(c(c1)C)c1csc(n1)c1cc2cccc(c2oc1=O)[N+](=O)[O-]

STK549967
Synonyms: N~2~-(butan-2-yl)-N~4~-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: CCC(Nc1nc(Nc2ccc(cc2)C)c(c(n1)N)[N+](=O)[O-])C

STK843991
Synonyms: 4-{(E)-2-cyano-2-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]ethenyl}-2,6-dimethoxyphenylacetate
Smiles: N#C/C(=C\c1cc(OC)c(c(c1)OC)OC(=O)C)/c1scc(n1)c1cccc2c1cccc2

STK549970
Synonyms: 2-{(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-4-(methylsulfanyl)butanoicacid
Smiles: CSCCC(N1C(=S)S/C(=C\C(=C\c2ccccc2)\C)/C1=O)C(=O)O

STK549971
Synonyms: 2-[(9-tert-butyl-1,5-dicyano-4-oxo-3-azaspiro[5.5]undec-1-en-2-yl)sulfanyl]-N-(2-ethylphenyl)acetamide
Smiles: N#CC1C(=O)NC(=C(C21CCC(CC2)C(C)(C)C)C#N)SCC(=O)Nc1ccccc1CC

STK549972
Synonyms: 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-{[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl}-N-phenylpyridine-3-carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2nccs2)nc(c(c1c1ccc(c(c1)OC)OC)C(=O)Nc1ccccc1)C

STK549976
Synonyms: N~2~-benzyl-N~4~-(4-fluorophenyl)-N~2~-methyl-5-nitropyrimidine-2,4,6-triamine
Smiles: Fc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N(Cc1ccccc1)C

STK549978
Synonyms: 5-cyano-4-(furan-2-yl)-2-methyl-6-({2-[(3-methylphenyl)amino]-2-oxoethyl}sulfanyl)-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK843994
Synonyms: (2Z)-3-[(3-acetylphenyl)amino]-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1)C(=O)C)/c1scc(n1)c1ccc(cc1Cl)Cl

STK549999
Synonyms: 1,1'-piperazine-1,4-diylbis[3-(4-methoxyphenoxy)propan-2-ol]
Smiles: COc1ccc(cc1)OCC(CN1CCN(CC1)CC(COc1ccc(cc1)OC)O)O

STK550000
Synonyms: N~4~-ethyl-N~6~-(2-iodophenyl)-7-nitro-2,1,3-benzoxadiazole-4,6-diamine
Smiles: CCNc1cc(Nc2ccccc2I)c(c2c1non2)[N+](=O)[O-]

STK550004
Synonyms: N~4~-benzyl-5-nitro-N~2~-(2-phenylethyl)pyrimidine-2,4,6-triamine
Smiles: [O-][N+](=O)c1c(NCc2ccccc2)nc(nc1N)NCCc1ccccc1

STK550006
Synonyms: 6-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(4-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2ccc(cc2)Cl)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK843999
Synonyms: 3-(1,3-benzoxazol-2-yl)-2-oxo-2H-chromen-7-ylcyclohexanecarboxylate
Smiles: O=C(C1CCCCC1)Oc1ccc2c(c1)oc(=O)c(c2)c1nc2c(o1)cccc2

STK550014
Synonyms: 4-({(E)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-N-(1,3-thiazol-2-yl)benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)/c1scc(n1)c1ccc(cc1)Br

STK550017
Synonyms: N~2~-(butan-2-yl)-N~4~-(4-chlorophenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: CCC(Nc1nc(Nc2ccc(cc2)Cl)c(c(n1)N)[N+](=O)[O-])C

STK550018
Synonyms: (2Z)-3-{[4-chloro-2-(trifluoromethyl)phenyl]amino}-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1C(F)(F)F)Cl)/c1scc(n1)c1cc2ccccc2oc1=O

STK550019
Synonyms: N~4~-(4-chlorophenyl)-N~2~-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: COc1ccc(cc1)Nc1nc(Nc2ccc(cc2)Cl)c(c(n1)N)[N+](=O)[O-]

STK550024
Synonyms: 4-[(cyclohexylamino)methyl]-2-methoxyphenol
Smiles: COc1cc(CNC2CCCCC2)ccc1O

STK550027
Synonyms: N~4~-benzyl-N~2~-[3-(dimethylamino)propyl]-5-nitropyrimidine-2,4,6-triamine
Smiles: CN(CCCNc1nc(NCc2ccccc2)c(c(n1)N)[N+](=O)[O-])C

STK550028
Synonyms: 2,4-dichloro-N-[(5Z)-5-(4-hydroxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: COc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1Cl)Cl

STK844003
Synonyms: ethyl5-cyano-6-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)C1=C(NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1)F)c1ccccc1

STK550035
Synonyms: N~4~-benzyl-N~2~-cyclohexyl-5-nitropyrimidine-2,4,6-triamine
Smiles: [O-][N+](=O)c1c(NCc2ccccc2)nc(nc1N)NC1CCCCC1

STK550036
Synonyms: (5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-3-(naphthalen-2-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)c1ccc2c(c1)cccc2

STK550037
Synonyms: 4-(2-chlorophenyl)-5-cyano-2-methyl-6-{[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanyl}-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc3c2cccc3)NC(=C(C1c1ccccc1Cl)C(=O)Nc1ccccc1)C

STK550040
Synonyms: N-(3,4-dimethylphenyl)-7-(morpholin-4-yl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Smiles: [O-][N+](=O)c1c(Nc2ccc(c(c2)C)C)cc(c2c1non2)N1CCOCC1

STK550041
Synonyms: (2Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[3,4-bis(benzyloxy)phenyl]prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(c(c1)OCc1ccccc1)OCc1ccccc1)/c1scc(n1)c1ccc2c(c1)OCO2

STK550052
Synonyms: 3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-oxo-2H-chromen-7-ylmorpholine-4-carboxylate
Smiles: Brc1ccc(cc1)c1csc(n1)c1cc2ccc(cc2oc1=O)OC(=O)N1CCOCC1

STK550053
Synonyms: (2Z)-[2-(4-bromophenyl)hydrazinylidene][4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)Br)/c1scc(n1)c1ccc(c(c1)OC)OC

STK550056
Synonyms: (5Z)-2-[(3-chlorophenyl)amino]-5-(4-hydroxy-3-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1cc(ccc1O)/C=C/1\SC(=NC1=O)Nc1cccc(c1)Cl

STK550060
Synonyms: N~4~-(4-chlorophenyl)-N~2~-methyl-5-nitro-N~2~-phenylpyrimidine-2,4,6-triamine
Smiles: Clc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N(c1ccccc1)C

STK550061
Synonyms: ethyl3-(4-bromophenyl)-7-{[(2-chlorophenyl)carbonyl]oxy}-4-oxo-4H-chromene-2-carboxylate
Smiles: CCOC(=O)c1oc2cc(ccc2c(=O)c1c1ccc(cc1)Br)OC(=O)c1ccccc1Cl

STK550062
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1ccccc1F)c([nH]2)C

STK550063
Synonyms: 4-methoxy-2-(3-nitrophenyl)quinazoline
Smiles: COc1nc(nc2c1cccc2)c1cccc(c1)[N+](=O)[O-]

STK550066
Synonyms: 3-(quinolin-8-ylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylicacid
Smiles: O=C(C1C2C=CC(C1C(=O)O)C2)Nc1cccc2c1nccc2

STK550068
Synonyms: 1-amino-8,8-dimethyl-5-(morpholin-4-yl)-N-(naphthalen-1-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1)Nc1cccc2c1cccc2

STK550069
Synonyms: 5-[3-(6-chloro-2-methyl-4-phenylquinolin-3-yl)-5-(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1ccccc1Cl)c1c(C)nc2c(c1c1ccccc1)cc(cc2)Cl

STK838652
Synonyms: 8-bromo-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: C=CCn1c(Br)nc2c1c(=O)n(C)c(=O)n2C

STK537424
Synonyms: N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
Smiles: CCC(=O)Nc1c(C)n[nH]c1C

STK839521
Synonyms: 2-{[(2,4-difluorophenyl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Smiles: Fc1ccc(c(c1)F)NC=C1C(=O)CC(CC1=O)(C)C

STK839541
Synonyms: 2-{[(3,4-difluorophenyl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Smiles: O=C1CC(C)(C)CC(=O)C1=CNc1ccc(c(c1)F)F

STK841512
Synonyms: 4-methyl-N'-(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)benzohydrazide
Smiles: Cc1ccc(cc1)C(=O)NNc1ncnc2c1cnn2C

STK843832
Synonyms: 4-fluoro-2-[5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenol
Smiles: Cc1ccc(cc1)C1NN=C(C1)c1cc(F)ccc1O

STK550070
Synonyms: 4-[(2E)-2-(3,4-dimethoxybenzylidene)hydrazinyl]-2-(2-fluorophenyl)quinazoline
Smiles: COc1cc(/C=N/Nc2nc(nc3c2cccc3)c2ccccc2F)ccc1OC

STK550071
Synonyms: N'-(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)-N,N-dimethylethane-1,2-diamine
Smiles: CN(CCNc1ncnc2c1[nH]c1c2cc(cc1)Cl)C

STK550072
Synonyms: 9-fluoro-7-hydroxy-3-methyl-N-[2-(morpholin-4-yl)ethyl]-5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-6-carboxamide
Smiles: Fc1cc2CCC(n3c2c(c1)c(O)c(c3=O)C(=O)NCCN1CCOCC1)C

STK550074
Synonyms: 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-[(1E)-1-(furan-2-yl)ethylidene]acetohydrazide
Smiles: O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)N/N=C(/c1ccco1)\C

STK550075
Synonyms: 4-{(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzoicacid
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)C(=O)O

STK550078
Synonyms: N'-cyclohexylidene-2-oxopiperidine-3-carbohydrazide
Smiles: O=C(C1CCCNC1=O)NN=C1CCCCC1

STK550082
Synonyms: (5Z)-2-[(2,3-dichlorophenyl)amino]-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-1,3-thiazol-4(5H)-one
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=NC1=O)Nc1cccc(c1Cl)Cl

STK844012
Synonyms: 3-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-8-nitro-2H-chromen-2-one
Smiles: Fc1ccc(cc1)c1csc(n1)c1cc2cccc(c2oc1=O)[N+](=O)[O-]

STK550088
Synonyms: 2-{[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]amino}benzoicacid
Smiles: N#C/C(=C\Nc1ccccc1C(=O)O)/c1nc2c(s1)cccc2

STK550091
Synonyms: (9E)-9-(4-methoxybenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-phenyl-6,7,8,9-tetrahydro-5H-pyrido[4,3-d][1,3]thiazolo[3,2-a]pyrimidine
Smiles: COc1ccc(cc1)/C=C/1\CN(C)CC2=C1N=c1scc(n1C2c1ccc(cc1)OC)c1ccccc1

STK550093
Synonyms: ethyl{[2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc(SC)nc2c1c1CCCCc1s2

STK550094
Synonyms: ethyl1-[2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxyquinazolin-4-yl]piperidine-4-carboxylate
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCC(CC1)C(=O)OCC)c1ccc(c(c1)OC)OC

STK550100
Synonyms: methyl5-({4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(phenoxymethyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-ethoxyphenoxy}methyl)furan-2-carboxylate
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)ccc1OCc1ccc(o1)C(=O)OC

STK550104
Synonyms: 4-{3-(3,4-dimethoxyphenyl)-5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-1-yl}-4-oxobutanoicacid
Smiles: COc1ccc(cc1OC)C1=NN(C(C1)c1ccc(cc1)N(C)C)C(=O)CCC(=O)O

STK550105
Synonyms: 3-bromo-2-oxo-N-(quinolin-3-yl)-2H-pyran-5-carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)Nc1cnc2c(c1)cccc2

STK844014
Synonyms: (5Z)-5-(4-hydroxy-3-methoxybenzylidene)-3-(4-hydroxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)O

STK844015
Synonyms: (2Z)-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl][2-(4-methoxyphenyl)hydrazinylidene]ethanenitrile
Smiles: COc1ccc(cc1)N/N=C(\c1scc(n1)c1ccc(c(c1)OC)OC)/C#N

STK550108
Synonyms: 2-{4-[(3,4-difluorophenyl)amino]quinazolin-2-yl}-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Nc2ccc(c(c2)F)F)c2c(n1)cccc2

STK550113
Synonyms: 2,4-dichloro-N-[(5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1Cl)Cl

STK550118
Synonyms: (5Z)-5-(2,3-dimethoxybenzylidene)-3-(3-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cccc(c1)N1C(=S)S/C(=C\c2cccc(c2OC)OC)/C1=O

STK550119
Synonyms: [(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl](phenyl)aceticacid
Smiles: OC(=O)C(N1C(=S)S/C(=C\c2cccs2)/C1=O)c1ccccc1

STK550127
Synonyms: N~2~-(4-ethoxyphenyl)-N~4~-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: CCOc1ccc(cc1)Nc1nc(N)c(c(n1)Nc1cccc(c1)C)[N+](=O)[O-]

STK550130
Synonyms: 4-{[(2E,5Z)-5-(4-fluorobenzylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoicacid
Smiles: Fc1ccc(cc1)/C=C/1\S/C(=N/c2ccc(cc2)C(=O)O)/N(C1=O)C

STK550132
Synonyms: 4-(benzylsulfanyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: CSc1nc(SCc2ccccc2)c2c(n1)sc1c2CCCC1

STK550136
Synonyms: N-(3-chlorophenyl)-2-{[3-cyano-4-(4-hydroxy-3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)Cl)NC2=C(C1c1ccc(c(c1)OC)O)C(=O)CCC2

STK550138
Synonyms: (4bR,7aS,8R)-6-(2-fluorophenyl)-8-(phenylcarbonyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: O=C([C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1F)c1ccccc1

STK844022
Synonyms: (4,5-diphenyl-1H-imidazol-1-yl)(piperidin-1-yl)methanone
Smiles: O=C(n1cnc(c1c1ccccc1)c1ccccc1)N1CCCCC1

STK550147
Synonyms: 4-({(Z)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-N-carbamimidoylbenzenesulfonamide
Smiles: N#C/C(=C/Nc1ccc(cc1)S(=O)(=O)NC(=N)N)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK550148
Synonyms: ethyl2-({(Z)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc(cc2)[N+](=O)[O-])/C#N)sc2c1CCCC2

STK550151
Synonyms: 8-bromo-1,3-dimethyl-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n(CCSc1ncccn1)c(n2)Br

STK550152
Synonyms: 5-(2-acetyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-cyclohexyl-6-hydroxy-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: CC(=O)N1CCc2c(C1c1c(O)[nH]c(=S)n(c1=O)C1CCCCC1)cccc2

STK550153
Synonyms: 2-[(5Z)-5-(2-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-methylbutanoicacid
Smiles: COc1ccccc1/C=C/1\SC(=S)N(C1=O)C(C(=O)O)C(C)C

STK844027
Synonyms: methyl4-{(E)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl}benzoate
Smiles: N#C/C(=C\c1ccc(cc1)C(=O)OC)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK844028
Synonyms: 2-(azepan-1-yl)-N-(2-fluorophenyl)-5-nitropyrimidine-4,6-diamine
Smiles: [O-][N+](=O)c1c(N)nc(nc1Nc1ccccc1F)N1CCCCCC1

STK844029
Synonyms: 2,4-dichloro-N-[(5Z)-5-(1H-indol-3-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)NN1C(=S)S/C(=C\c2c[nH]c3c2cccc3)/C1=O

STK844030
Synonyms: 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitropyrimidine-4,6-diamine
Smiles: COc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCCCCC1

STK844031
Synonyms: (5Z)-3-(4-fluorophenyl)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)F

STK844033
Synonyms: N~4~-(furan-2-ylmethyl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4,6-triamine
Smiles: [O-][N+](=O)c1c(N)nc(nc1NCc1ccco1)NCCCN1CCOCC1

STK550177
Synonyms: 1-[2-(5-methoxy-2-methyl-1H-indol-3-yl)-2-oxoethyl]piperidine-4-carboxamide
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCC(CC1)C(=O)N)c([nH]2)C

STK550178
Synonyms: 5-[(1-benzyl-1H-indol-3-yl)methylidene]-1,3-diethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=O)C(=Cc2cn(c3c2cccc3)Cc2ccccc2)C(=O)N(C1=S)CC

STK550179
Synonyms: (2Z)-[2-(4-methoxyphenyl)hydrazinylidene][4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: COc1ccc(cc1)N/N=C(\c1scc(n1)c1ccc(cc1)OC)/C#N

STK550180
Synonyms: 4-{(Z)-2-cyano-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl}-2,6-dimethoxyphenylacetate
Smiles: N#C/C(=C/c1cc(OC)c(c(c1)OC)OC(=O)C)/c1scc(n1)c1ccc(cc1C)C

STK550181
Synonyms: 3-[(5Z)-2,4-dioxo-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]propanoicacid
Smiles: OC(=O)CCN1C(=O)S/C(=C\c2cccs2)/C1=O

STK550182
Synonyms: N~4~-(4-chlorophenyl)-N~2~-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: Cc1ccc(cc1)Nc1nc(Nc2ccc(cc2)Cl)c(c(n1)N)[N+](=O)[O-]

STK550184
Synonyms: (5Z)-5-(4-hydroxy-3-methoxybenzylidene)-2-[(4-methylphenyl)amino]-1,3-thiazol-4(5H)-one
Smiles: COc1cc(ccc1O)/C=C/1\SC(=NC1=O)Nc1ccc(cc1)C

STK550190
Synonyms: (5Z)-3-(3,4-dichlorophenyl)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)c1ccc(c(c1)Cl)Cl

STK550191
Synonyms: (2Z)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-[(4-butylphenyl)amino]prop-2-enenitrile
Smiles: CCCCc1ccc(cc1)N/C=C(\c1scc(n1)c1cc2cc(Br)ccc2oc1=O)/C#N

STK550193
Synonyms: 4-(4-methoxyphenyl)-7,7-dimethyl-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)C)NC2=C(C1c1ccc(cc1)OC)C(=O)CC(C2)(C)C

STK550197
Synonyms: 2-(2,6-dimethylmorpholin-4-yl)-N-(4-methoxyphenyl)-5-nitropyrimidine-4,6-diamine
Smiles: COc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CC(C)OC(C1)C

STK550200
Synonyms: (5Z)-3-(naphthalen-2-yl)-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2cccs2)/C(=O)N1c1ccc2c(c1)cccc2

STK550202
Synonyms: 4-(3,5-dimethylphenoxy)-2-(pyridin-4-yl)quinazoline
Smiles: Cc1cc(C)cc(c1)Oc1nc(nc2c1cccc2)c1ccncc1

STK550204
Synonyms: methyl3-[({1-[(4,6-dimethyl-2-oxo-2H-pyran-5-yl)carbonyl]-1H-pyrazol-3-yl}carbonyl)amino]benzoate
Smiles: COC(=O)c1cccc(c1)NC(=O)c1ccn(n1)C(=O)c1c(C)cc(=O)oc1C

STK844039
Synonyms: 2-{4-[(1-phenylethyl)amino]quinazolin-2-yl}phenol
Smiles: CC(c1ccccc1)Nc1nc(nc2c1cccc2)c1ccccc1O

STK844042
Synonyms: 6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)NCc2ccccc2)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK550214
Synonyms: ethyl1-amino-5-(morpholin-4-yl)-8-(propan-2-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxylate
Smiles: CCOC(=O)c1sc2c(c1N)c1CC(OCc1c(n2)N1CCOCC1)C(C)C

STK550215
Synonyms: (2Z)-[2-(4-chlorophenyl)hydrazinylidene][4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)Cl)/c1scc(n1)c1ccc(cc1)OC

STK550216
Synonyms: 4-butyl-7-ethoxy-2,3,5a,10b-tetrahydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3OCC

STK550223
Synonyms: N~2~-methyl-N~4~-(3-methylphenyl)-5-nitro-N~2~-phenylpyrimidine-2,4,6-triamine
Smiles: Cc1cccc(c1)Nc1nc(nc(c1[N+](=O)[O-])N)N(c1ccccc1)C

STK550225
Synonyms: (2Z)-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl][2-(4-methylphenyl)hydrazinylidene]ethanenitrile
Smiles: COc1cccc(c1)c1csc(n1)/C(=N\Nc1ccc(cc1)C)/C#N

STK550230
Synonyms: 8-fluoro-N-[2-(morpholin-4-yl)ethyl]-5H-pyrimido[5,4-b]indol-4-amine
Smiles: Fc1ccc2c(c1)c1ncnc(c1[nH]2)NCCN1CCOCC1

STK550234
Synonyms: N~4~-(2-fluorophenyl)-N~2~-(3-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: Fc1cccc(c1)Nc1nc(N)c(c(n1)Nc1ccccc1F)[N+](=O)[O-]

STK550237
Synonyms: N-[3-(1H-benzotriazol-1-yl)-2-hydroxypropyl]-N-(4-methylphenyl)benzenesulfonamide
Smiles: Cc1ccc(cc1)N(S(=O)(=O)c1ccccc1)CC(Cn1nnc2c1cccc2)O

STK550241
Synonyms: 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-N-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)N)NC(=C(C1c1ccco1)C(=O)Nc1ccc(cc1)F)C

STK550248
Synonyms: (5Z)-2-{[3-(trifluoromethyl)phenyl]amino}-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1cc(/C=C/2\SC(=NC2=O)Nc2cccc(c2)C(F)(F)F)cc(c1OC)OC

STK844047
Synonyms: (5Z)-3-[4-(diethylamino)phenyl]-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)N(CC)CC

STK550254
Synonyms: 2-(methylsulfanyl)-4-(propan-2-ylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: CSc1nc(SC(C)C)c2c(n1)sc1c2CCCC1

STK550260
Synonyms: 3-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]-8-nitro-2H-chromen-2-one
Smiles: O=c1oc2c(cc1c1scc(n1)c1cccc3c1cccc3)cccc2[N+](=O)[O-]

STK550267
Synonyms: (5Z)-2-[(4-chlorophenyl)amino]-5-(2,5-dimethoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1ccc(cc1/C=C/1\SC(=NC1=O)Nc1ccc(cc1)Cl)OC

STK550269
Synonyms: 4-{[7-(dimethylamino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: [O-][N+](=O)c1c(Nc2c(C)n(n(c2=O)c2ccccc2)C)cc(c2c1non2)N(C)C

STK550271
Synonyms: 3,5-diethyl-2-[(2-hydroxyethyl)amino]-5-methyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: OCCNc1nc2c3ccccc3CC(c2c(=O)n1CC)(C)CC

STK550272
Synonyms: 3-[(5Z)-5-(3-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoicacid
Smiles: Fc1cccc(c1)/C=C/1\SC(=S)N(C1=O)c1cccc(c1)C(=O)O

STK550278
Synonyms: 5-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl}-3-bromo-2H-pyran-2-one
Smiles: O=C(c1coc(=O)c(c1)Br)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK844051
Synonyms: N~2~-benzyl-N~4~-(furan-2-ylmethyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: [O-][N+](=O)c1c(NCc2ccco2)nc(nc1N)NCc1ccccc1

STK550281
Synonyms: (2Z)-3-[(3-chloro-4-fluorophenyl)amino]-2-[4-(naphthalen-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(c(c1)Cl)F)/c1scc(n1)c1ccc2c(c1)cccc2

STK550283
Synonyms: 9-[(1Z)-N-hydroxyethanimidoyl]-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-4-ol
Smiles: O/N=C(\c1c2CCN(Cc2c(c2c1OCO2)O)C)/C

STK550290
Synonyms: 2-[4-(4-benzylpiperidin-1-yl)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(N2CCC(CC2)Cc2ccccc2)c2c(n1)cccc2

STK550294
Synonyms: N-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-nitrobenzamide
Smiles: COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)NC(=O)c1cccc(c1)[N+](=O)[O-]

STK844056
Synonyms: (2Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-[(2-fluoro-5-nitrophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1cc(ccc1F)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)Br

STK844057
Synonyms: ethyl2-({(E)-2-cyano-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1N/C=C(/c1scc(n1)c1cccc(c1)OC)\C#N

STK550302
Synonyms: (5Z)-5-(2,5-dimethoxybenzylidene)-3-(3-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(c(c1)/C=C/1\SC(=S)N(C1=O)c1cccc(c1)OC)OC

STK550307
Synonyms: 4-(2,4-dichlorophenoxy)-2-(pyridin-2-yl)quinazoline
Smiles: Clc1ccc(c(c1)Cl)Oc1nc(nc2c1cccc2)c1ccccn1

STK844059
Synonyms: 1,3-dimethyl-7-(3-methylbenzyl)-8-{[2-(morpholin-4-yl)ethyl]sulfanyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(SCCN2CCOCC2)nc2c1c(=O)n(c(=O)n2C)C

STK550310
Synonyms: (5Z)-5-[4-(prop-2-en-1-yloxy)benzylidene]-2-thioxo-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
Smiles: C=CCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1cccc(c1)C(F)(F)F

STK550313
Synonyms: [5-(2,3-dimethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl](2-fluorophenyl)methanone
Smiles: COc1cccc(c1OC)C1CC(=NN1C(=O)c1ccccc1F)c1ccc(cc1)C

STK550318
Synonyms: 10-butyl-7,8,9,11a-tetrahydro-6bH-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncn1c3ncn1

STK550319
Synonyms: 2-(4-benzylpiperazin-1-yl)-N'-[(E)-(3-phenoxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1)N/N=C/c1cccc(c1)Oc1ccccc1

STK550321
Synonyms: 1-(furan-2-yl)-3-methyl-N-(1-phenylethyl)but-3-en-1-amine
Smiles: CC(=C)CC(c1ccco1)NC(c1ccccc1)C

STK844062
Synonyms: 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-N-(2-methylphenyl)-6-(methylsulfanyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SC)NC(=C(C1c1ccc(c(c1)OC)OC)C(=O)Nc1ccccc1C)C

STK550325
Synonyms: N-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)acetamide
Smiles: COc1c2CN(C)CCc2c(c2c1OCO2)NC(=O)C

STK550327
Synonyms: 3,5-dimethoxy-N-{[2-(pyrazin-2-ylcarbonyl)hydrazinyl]carbonothioyl}benzamide
Smiles: COc1cc(OC)cc(c1)C(=O)NC(=S)NNC(=O)c1cnccn1

STK550330
Synonyms: (2Z)-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl][2-(4-methoxyphenyl)hydrazinylidene]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)OC)/c1scc(n1)c1ccc(cc1Cl)Cl

STK550332
Synonyms: 4-butyl-N-(2-methylpropyl)-2,3,5a,10b-tetrahydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3NCC(C)C

STK550335
Synonyms: (1E)-N-hydroxy-1-(1H-indol-5-yl)ethanimine
Smiles: O/N=C(/c1ccc2c(c1)cc[nH]2)\C

STK550338
Synonyms: N~2~-(4-chlorophenyl)-N~4~-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: Cc1ccc(cc1)Nc1nc(Nc2ccc(cc2)Cl)nc(c1[N+](=O)[O-])N

STK844065
Synonyms: 3-hydroxy-N-{(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzamide
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1cccc(c1)O

STK844066
Synonyms: ethyl2-{[(Z)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino}benzoate
Smiles: CCOC(=O)c1ccccc1N/C=C(\c1scc(n1)c1ccccc1)/C#N

STK550347
Synonyms: 3-(1,3-benzothiazol-2-yl)-2-oxo-2H-chromen-7-yl2-bromobenzoate
Smiles: O=c1oc2cc(ccc2cc1c1nc2c(s1)cccc2)OC(=O)c1ccccc1Br

STK844067
Synonyms: (2Z)-3-[(3-chloro-4-fluorophenyl)amino]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(c(c1)Cl)F)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK844068
Synonyms: 3-chloro-N-[(5Z)-5-(4-hydroxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: COc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)NC(=O)c1cccc(c1)Cl

STK550352
Synonyms: 1-(4-chloro-3-nitrophenyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc(c(c1)[N+](=O)[O-])Cl

STK550355
Synonyms: {[2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]sulfanyl}aceticacid
Smiles: CSc1nc(SCC(=O)O)c2c(n1)sc1c2CCCC1

STK550356
Synonyms: (2Z)-[2-(4-methoxyphenyl)hydrazinylidene][4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)OC)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK550357
Synonyms: 6-({2-[(4-bromophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(4-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2ccc(cc2)Br)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK844071
Synonyms: N-[5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-2-(morpholin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide
Smiles: O=C(Nc1cc(ccc1N1CCOCC1)c1nn(C)c(=O)c2c1cccc2)COc1cccc(c1)C

STK550362
Synonyms: N-(3-methylphenyl)-2-(4-methylpiperidin-1-yl)-5-nitropyrimidine-4,6-diamine
Smiles: CC1CCN(CC1)c1nc(Nc2cccc(c2)C)c(c(n1)N)[N+](=O)[O-]

STK550363
Synonyms: 4-(ethylsulfanyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: CCSc1nc(SC)nc2c1c1CCCCc1s2

STK550365
Synonyms: 5-cyano-4-(furan-2-yl)-6-({2-[(3-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)OC)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK550368
Synonyms: 2-[(5Z)-5-(2,5-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-methylbutanoicacid
Smiles: COc1ccc(cc1/C=C/1\SC(=S)N(C1=O)C(C(=O)O)C(C)C)OC

STK550370
Synonyms: 3-(1,3-benzothiazol-2-yl)-6-ethyl-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl2-chlorobenzoate
Smiles: CCc1cc2c(cc1OC(=O)c1ccccc1Cl)oc(c(c2=O)c1nc2c(s1)cccc2)C(F)(F)F

STK550372
Synonyms: 1-benzyl-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine
Smiles: FC(c1nnc(s1)N1CCN(CC1)Cc1ccccc1)(F)F

STK844074
Synonyms: 2-[2-hydroxy-3-(4-methoxyphenoxy)propoxy]-1H-isoindole-1,3(2H)-dione
Smiles: COc1ccc(cc1)OCC(CON1C(=O)c2c(C1=O)cccc2)O

STK550381
Synonyms: N-(4-methylphenyl)-2-[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(Nc1ccc(cc1)C)COc1ccc2c(c1C)oc(=O)c(c2C)C

STK550382
Synonyms: dipropan-2-yl[(2,4-dimethoxyphenyl)(hydroxy)methyl]phosphonate
Smiles: COc1cc(OC)ccc1C(P(=O)(OC(C)C)OC(C)C)O

STK550383
Synonyms: 2-{[2-hydroxy-3-(4-methylphenoxy)propyl]carbamoyl}benzoicacid
Smiles: OC(COc1ccc(cc1)C)CNC(=O)c1ccccc1C(=O)O

STK844075
Synonyms: (2Z)-3-[(4-fluoro-2-nitrophenyl)amino]-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1[N+](=O)[O-])F)/c1scc(n1)c1cc2ccccc2oc1=O

STK550386
Synonyms: (2Z)-3-{[4-chloro-3-(trifluoromethyl)phenyl]amino}-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(c(c1)C(F)(F)F)Cl)/c1scc(n1)c1cc2ccccc2oc1=O

STK550387
Synonyms: 2-{[3-cyano-4-(4-hydroxy-3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C(F)(F)F)NC2=C(C1c1ccc(c(c1)OC)O)C(=O)CCC2

STK844078
Synonyms: (2Z)-[2-(4-fluorophenyl)hydrazinylidene][4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)F)/c1scc(n1)c1cc2ccccc2oc1=O

STK550402
Synonyms: 5-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1ccccc1)c1ccccc1

STK844082
Synonyms: ethyl2-({(E)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1N/C=C(/c1scc(n1)c1ccc(cc1)Br)\C#N

STK550418
Synonyms: N-[(5Z)-5-(2,5-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-hydroxybenzamide
Smiles: COc1ccc(c(c1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1cccc(c1)O)OC

STK550420
Synonyms: 1,5-dimethyl-4-{[7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CC1CCCN(C1)c1cc(Nc2c(C)n(n(c2=O)c2ccccc2)C)c(c2c1non2)[N+](=O)[O-]

STK844085
Synonyms: 2-methoxy-6-[4-(3-methylpiperidin-1-yl)quinazolin-2-yl]phenol
Smiles: COc1cccc(c1O)c1nc2ccccc2c(n1)N1CCCC(C1)C

STK550430
Synonyms: 2-(4-benzylpiperidin-1-yl)-N-(4-chlorophenyl)-5-nitropyrimidine-4,6-diamine
Smiles: Clc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCC(CC1)Cc1ccccc1

STK550431
Synonyms: 3,7-bis[(2-bromophenyl)carbonyl]-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Smiles: O=C1C2(C)CN(CC1(C)CN(C2)C(=O)c1ccccc1Br)C(=O)c1ccccc1Br

STK844087
Synonyms: 1-(piperidin-1-yl)-2-{4-[4-(piperidin-1-yl)phthalazin-1-yl]phenoxy}ethanone
Smiles: O=C(N1CCCCC1)COc1ccc(cc1)c1nnc(c2c1cccc2)N1CCCCC1

STK844088
Synonyms: 4-methyl-N-[5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-2-(morpholin-4-yl)phenyl]benzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1cc(ccc1N1CCOCC1)c1nn(C)c(=O)c2c1cccc2

STK550435
Synonyms: 2-[(5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoicacid
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)CC

STK550440
Synonyms: 4-{[2-(2-fluorophenyl)quinazolin-4-yl]oxy}benzonitrile
Smiles: N#Cc1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccccc1F

STK550444
Synonyms: 3-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-8-nitro-2H-chromen-2-one
Smiles: COc1cccc(c1)c1csc(n1)c1cc2cccc(c2oc1=O)[N+](=O)[O-]

STK550447
Synonyms: (2E)-3-[(3-chloro-4-fluorophenyl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)F)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK550448
Synonyms: 1-(3-methylphenoxy)-3-(pyrrolidin-1-yl)propan-2-ol
Smiles: OC(CN1CCCC1)COc1cccc(c1)C

STK550451
Synonyms: 2-bromo-N-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccccc1Br

STK550457
Synonyms: 1-amino-5-(morpholin-4-yl)-N-(2-phenylethyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)NCCc1ccccc1

STK550462
Synonyms: 2-{[3-cyano-4-(4-hydroxy-3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C)NC2=C(C1c1ccc(c(c1)OC)O)C(=O)CCC2

STK550467
Synonyms: N-carbamimidoyl-4-({(E)-2-cyano-2-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)NC(=N)N)/c1scc(n1)c1ccc(cc1)C1CCCCC1

STK844093
Synonyms: 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-4H-chromen-7-ylmorpholine-4-carboxylate
Smiles: O=C(N1CCOCC1)Oc1ccc2c(c1)oc(c(c2=O)c1nc2c(s1)cccc2)C

STK550474
Synonyms: N-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-4-fluorobenzamide
Smiles: COc1cccc(c1OC)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)F

STK550476
Synonyms: 7-hydroxy-6-(prop-2-en-1-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Smiles: C=CCc1c(O)nc2n(c1=O)CCS2

STK844094
Synonyms: 3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-4H-chromen-7-yl2-chlorobenzoate
Smiles: O=C(c1ccccc1Cl)Oc1ccc2c(c1C)occ(c2=O)c1nc2c(s1)cccc2

STK550478
Synonyms: 2-amino-9-(2-fluorophenyl)-4-methyl-7-oxo-6,7,8,9-tetrahydrothieno[2,3-b:4,5-b']dipyridine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1C)sc1c2C(CC(=O)N1)c1ccccc1F

STK844096
Synonyms: 2-methoxy-N-[5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-2-(morpholin-4-yl)phenyl]benzamide
Smiles: COc1ccccc1C(=O)Nc1cc(ccc1N1CCOCC1)c1nn(C)c(=O)c2c1cccc2

STK844097
Synonyms: 4-[(Z)-2-cyano-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}ethenyl]-2,6-dimethoxyphenylacetate
Smiles: N#C/C(=C/c1cc(OC)c(c(c1)OC)OC(=O)C)/c1scc(n1)c1ccc(cc1)CC(C)C

STK550485
Synonyms: 2-(2-fluorophenyl)-4-(4-methylphenoxy)quinazoline
Smiles: Cc1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccccc1F

STK550487
Synonyms: benzyl5-cyano-4-(furan-2-yl)-6-({2-[(4-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)OC)NC(=C(C1c1ccco1)C(=O)OCc1ccccc1)C

STK844098
Synonyms: methyl4-{(Z)-2-cyano-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl}benzoate
Smiles: N#C/C(=C/c1ccc(cc1)C(=O)OC)/c1scc(n1)c1ccc(cc1)F

STK550489
Synonyms: (2Z)-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl][2-(4-ethylphenyl)hydrazinylidene]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)CC)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK550491
Synonyms: ethyl5-bromo-3-{[3-(3,5-dimethylpiperidin-1-yl)propanoyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CC(C)CC(C1)C)cc(cc2)Br

STK550496
Synonyms: 1-methyl-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine
Smiles: CN1CCN(CC1)c1nnc(s1)C(F)(F)F

STK550498
Synonyms: N-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-4-hydroxybenzamide
Smiles: COc1cccc(c1OC)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)O

STK550502
Synonyms: 3-bromo-N-(6-methylpyridin-2-yl)-2-oxo-2H-pyran-5-carboxamide
Smiles: Cc1cccc(n1)NC(=O)c1coc(=O)c(c1)Br

STK844105
Synonyms: dimethyl5-({(Z)-2-cyano-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzene-1,3-dicarboxylate
Smiles: N#C/C(=C/Nc1cc(cc(c1)C(=O)OC)C(=O)OC)/c1scc(n1)c1ccc(cc1)C

STK550512
Synonyms: 3-(4-chlorophenyl)-2-[(Z)-(5-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)n1c(/C=C/2\C(=O)Nc3c2cc(C)cc3)nc2c(c1=O)cccc2

STK844109
Synonyms: N~2~,N~4~-dibenzyl-5-nitropyrimidine-2,4,6-triamine
Smiles: [O-][N+](=O)c1c(NCc2ccccc2)nc(nc1N)NCc1ccccc1

STK550523
Synonyms: [1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl](4-methyl-1,3-thiazol-5-yl)methanone
Smiles: CCOc1cc(ccc1OCC)CC1c2cc(OCC)c(cc2CCN1C(=O)c1scnc1C)OCC

STK844110
Synonyms: N-[(5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-2-methoxybenzamide
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccccc1OC

STK550524
Synonyms: 3-[(2,4-dimethylphenyl)sulfonyl]-2-(4-methylphenyl)-1,3-thiazolidine
Smiles: Cc1ccc(cc1)C1SCCN1S(=O)(=O)c1ccc(cc1C)C

STK550531
Synonyms: N~6~-(3,4-dimethylphenyl)-N~4~-ethyl-7-nitro-2,1,3-benzoxadiazole-4,6-diamine
Smiles: CCNc1cc(Nc2ccc(c(c2)C)C)c(c2c1non2)[N+](=O)[O-]

STK844113
Synonyms: (2Z)-3-[(3,4-difluorophenyl)amino]-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(c(c1)F)F)/c1scc(n1)c1ccc(c(c1)OC)OC

STK550534
Synonyms: N-[3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-phenylpropyl]thiophene-2-carboxamide
Smiles: O=C(c1cccs1)NCCC(c1ccccc1)C1CCOC(C1)(C)C

STK844114
Synonyms: 2-chloro-N-[5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-2-(morpholin-4-yl)phenyl]benzamide
Smiles: O=C(c1ccccc1Cl)Nc1cc(ccc1N1CCOCC1)c1nn(C)c(=O)c2c1cccc2

STK844115
Synonyms: 4-{(Z)-2-cyano-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl}phenylacetate
Smiles: N#C/C(=C/c1ccc(cc1)OC(=O)C)/c1scc(n1)c1ccc(cc1)F

STK844116
Synonyms: 3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-4H-chromen-7-yl2-methoxybenzoate
Smiles: COc1ccccc1C(=O)Oc1ccc2c(c1C)occ(c2=O)c1nc2c(s1)cccc2

STK550541
Synonyms: 10-(4-ethylphenyl)pyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
Smiles: CCc1ccc(cc1)n1c2ccccc2cc2c1nc(=O)[nH]c2=O

STK844117
Synonyms: 2-{[5,6-di(furan-2-yl)-1,2,4-triazin-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(c(n1)c1ccco1)c1ccco1

STK550543
Synonyms: 2-[4-(diethylamino)quinazolin-2-yl]-6-methoxyphenol
Smiles: CCN(c1nc(nc2c1cccc2)c1cccc(c1O)OC)CC

STK550547
Synonyms: 5-[5-(2-chlorophenyl)-3-(4-ethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: CCc1ccc(cc1)C1=NN(C(C1)c1ccccc1Cl)C(=O)CCCC(=O)O

STK550557
Synonyms: ethyl7-[(3,4-dihydroisoquinolin-2(1H)-ylacetyl)amino]-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cccc3)cc1c(c2)OCO1

STK550558
Synonyms: N~2~,N~2~-dimethyl-N~4~-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: Cc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N(C)C

STK550560
Synonyms: 1-{1,4-dioxo-3-[(phenylsulfonyl)amino]-1,4-dihydronaphthalen-2-yl}piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)C1=C(NS(=O)(=O)c2ccccc2)C(=O)c2c(C1=O)cccc2

STK550561
Synonyms: N~4~-(4-chlorophenyl)-N~2~-cyclohexyl-5-nitropyrimidine-2,4,6-triamine
Smiles: Clc1ccc(cc1)Nc1nc(NC2CCCCC2)nc(c1[N+](=O)[O-])N

STK844120
Synonyms: N-(4-{[4-(4-ethoxyphenyl)phthalazin-1-yl]amino}phenyl)acetamide
Smiles: CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc(cc1)NC(=O)C

STK550572
Synonyms: 2,4-dichloro-N-{(5Z)-4-oxo-5-[4-(prop-2-en-1-yloxy)benzylidene]-2-thioxo-1,3-thiazolidin-3-yl}benzamide
Smiles: C=CCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1Cl)Cl

STK550573
Synonyms: (2E)-3-{[4-chloro-2-(trifluoromethyl)phenyl]amino}-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(F)(F)F)Cl)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK550575
Synonyms: prop-2-en-1-yl5-cyano-6-{[2-(diphenylamino)-2-oxoethyl]sulfanyl}-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(c(c1)OC)O)C#N)SCC(=O)N(c1ccccc1)c1ccccc1

STK550578
Synonyms: 4-(2,3-dimethylphenoxy)-2-(pyridin-4-yl)quinazoline
Smiles: Cc1cccc(c1C)Oc1nc(nc2c1cccc2)c1ccncc1

STK550582
Synonyms: 2-[(4-amino-6-propyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCC(=O)N

STK550583
Synonyms: 2-methoxyethyl6-[(2-chlorobenzyl)sulfanyl]-4-(2-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCc1ccccc1Cl

STK844122
Synonyms: 9-chloro-5-phenyl-2-(thiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: Clc1ccc2c(c1)C1CC(=NN1C(O2)c1ccccc1)c1cccs1

STK844123
Synonyms: (2Z)-3-[(4-fluoro-2-nitrophenyl)amino]-2-[4-(naphthalen-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1[N+](=O)[O-])F)/c1scc(n1)c1ccc2c(c1)cccc2

STK550592
Synonyms: (4-chlorophenyl)[1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl]methanone
Smiles: CCOc1cc(ccc1OCC)CC1N(CCc2c1cc(OCC)c(c2)OCC)C(=O)c1ccc(cc1)Cl

STK550593
Synonyms: 1-(cyclohex-3-en-1-ylmethoxy)-3-(dibenzylamino)propan-2-ol
Smiles: OC(CN(Cc1ccccc1)Cc1ccccc1)COCC1CCC=CC1

STK550594
Synonyms: 2-(2,4-dichlorophenoxy)-1-[1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl]ethanone
Smiles: CCOc1cc2c(cc1OCC)CCN(C2Cc1ccc(c(c1)OCC)OCC)C(=O)COc1ccc(cc1Cl)Cl

STK550597
Synonyms: (5Z)-2-[(3,4-dimethylphenyl)amino]-5-(2-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1ccccc1/C=C/1\SC(=NC1=O)Nc1ccc(c(c1)C)C

STK550598
Synonyms: 5-(2-methoxyphenyl)-1-phenyl-3-(phenylcarbonyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Smiles: COc1ccccc1N1C(=O)C2C(C1=O)N(N=C2C(=O)c1ccccc1)c1ccccc1

STK550599
Synonyms: N,N-dimethyl-N'-[2-(pyridin-4-yl)quinazolin-4-yl]propane-1,3-diamine
Smiles: CN(CCCNc1nc(nc2c1cccc2)c1ccncc1)C

STK844126
Synonyms: (2Z)-[2-(4-chlorophenyl)hydrazinylidene][4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)Cl)/c1scc(n1)c1ccc(cc1)F

STK550600
Synonyms: N-[(5Z)-5-(2,5-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-2-hydroxybenzamide
Smiles: COc1ccc(c(c1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccccc1O)OC

STK550608
Synonyms: N-[(4E)-2-(4-methoxyphenyl)-4H-chromen-4-ylidene]-N'-phenylbenzene-1,4-diamine
Smiles: COc1ccc(cc1)c1c/c(=N\c2ccc(cc2)Nc2ccccc2)/c2c(o1)cccc2

STK550609
Synonyms: (4E)-4-[(2E)-(4-phenyl-1,3-thiazol-2(3H)-ylidene)hydrazinylidene]-1,3-thiazolidin-2-one
Smiles: O=C1SC/C(=N\N=c/2\scc([nH]2)c2ccccc2)/N1

STK550611
Synonyms: 4-bromo-N-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: COc1cccc(c1OC)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)Br

STK550612
Synonyms: 1-[1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]ethanone
Smiles: CCOc1cc(ccc1OCC)CC1N(CCc2c1cc(OCC)c(c2)OCC)C(=O)CSc1nccn1C

STK550613
Synonyms: 4-[(5Z)-5-(2-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoicacid
Smiles: COc1ccccc1/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)C(=O)O

STK844128
Synonyms: (5Z)-3-(4-ethoxyphenyl)-5-(2-methoxybenzylidene)-1,3-thiazolidine-2,4-dione
Smiles: CCOc1ccc(cc1)N1C(=O)S/C(=C\c2ccccc2OC)/C1=O

STK844129
Synonyms: dimethyl5-{[(Z)-2-cyano-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}ethenyl]amino}benzene-1,3-dicarboxylate
Smiles: N#C/C(=C/Nc1cc(cc(c1)C(=O)OC)C(=O)OC)/c1scc(n1)c1ccc(cc1)CC(C)C

STK550633
Synonyms: 2-{[4-amino-6-(benzylamino)-5-nitropyrimidin-2-yl]amino}ethanol
Smiles: OCCNc1nc(NCc2ccccc2)c(c(n1)N)[N+](=O)[O-]

STK550637
Synonyms: 2-[(5Z)-5-(2,5-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoicacid
Smiles: CCC(N1C(=S)S/C(=C\c2cc(OC)ccc2OC)/C1=O)C(=O)O

STK550645
Synonyms: 2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxy-N-[3-(morpholin-4-yl)propyl]quinazolin-4-amine
Smiles: CCOc1cc2nc(nc(c2cc1OC)NCCCN1CCOCC1)c1ccc(c(c1)OC)OC

STK550650
Synonyms: (2E)-[2-(4-methylphenyl)hydrazinylidene][4-(naphthalen-1-yl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: N#C/C(=N\Nc1ccc(cc1)C)/c1scc(n1)c1cccc2c1cccc2

STK844133
Synonyms: 4'-[2-hydroxy-3-(morpholin-4-yl)propoxy]biphenyl-4-carbonitrile
Smiles: OC(CN1CCOCC1)COc1ccc(cc1)c1ccc(cc1)C#N

STK550653
Synonyms: N-carbamimidoyl-4-({(E)-2-cyano-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)NC(=N)N)/c1scc(n1)c1ccc(cc1)F

STK844134
Synonyms: N-[5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-2-(morpholin-4-yl)phenyl]benzenesulfonamide
Smiles: O=c1n(C)nc(c2c1cccc2)c1ccc(c(c1)NS(=O)(=O)c1ccccc1)N1CCOCC1

STK550654
Synonyms: 2-[4-(benzylamino)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(NCc2ccccc2)c2c(n1)cccc2

STK550655
Synonyms: 2-(methylsulfanyl)-4-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: CSc1nc(SC/C=C/c2ccccc2)c2c(n1)sc1c2CCCC1

STK550660
Synonyms: 1-(2,5-dimethoxyphenyl)-3-[(2R)-1-hydrazinyl-1-oxo-3-phenylpropan-2-yl]urea(non-preferredname)
Smiles: NNC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1cc(OC)ccc1OC

STK844139
Synonyms: N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-oxo-2H-chromene-3-carboxamide
Smiles: O=C(c1cc2ccccc2oc1=O)Nc1c(nc2n1cccc2C)c1ccccc1

STK550664
Synonyms: N-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-2-nitrobenzamide
Smiles: COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccccc1[N+](=O)[O-]

STK550668
Synonyms: 2-methoxy-6-[4-(2-methylpiperidin-1-yl)quinazolin-2-yl]phenol
Smiles: COc1cccc(c1O)c1nc2ccccc2c(n1)N1CCCCC1C

STK844142
Synonyms: N,N-diethyl-4,5-diphenyl-1H-imidazole-1-carboxamide
Smiles: CCN(C(=O)n1cnc(c1c1ccccc1)c1ccccc1)CC

STK550669
Synonyms: N'-[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetohydrazide
Smiles: Cl/C(=C\c1ccccc1)/C=N/NC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C

STK550675
Synonyms: N-(4-chlorophenyl)-2-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidine-4,6-diamine
Smiles: CC1OC(C)CN(C1)c1nc(Nc2ccc(cc2)Cl)c(c(n1)N)[N+](=O)[O-]

STK844143
Synonyms: ethyl2-({(E)-2-cyano-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1N/C=C(/c1scc(n1)c1ccc(cc1)F)\C#N

STK550680
Synonyms: (2Z)-3-[(2,4-difluorophenyl)amino]-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: COc1cccc(c1)c1csc(n1)/C(=C\Nc1ccc(cc1F)F)/C#N

STK550681
Synonyms: 2-methoxyethyl4-(4-chlorophenyl)-5-cyano-6-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)NC1CCCCC1

STK844144
Synonyms: dimethyl5-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzene-1,3-dicarboxylate
Smiles: N#C/C(=C/Nc1cc(cc(c1)C(=O)OC)C(=O)OC)/c1scc(n1)c1ccc2c(c1)OCO2

STK550682
Synonyms: N-[(5Z)-5-(3-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-4-nitrobenzamide
Smiles: Fc1cccc(c1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)[N+](=O)[O-]

STK550689
Synonyms: N~4~-(4-fluorophenyl)-N~2~-(furan-2-ylmethyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: Fc1ccc(cc1)Nc1nc(NCc2ccco2)nc(c1[N+](=O)[O-])N

STK550690
Synonyms: (5Z)-2-[(3-chlorophenyl)amino]-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-1,3-thiazol-4(5H)-one
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=NC1=O)Nc1cccc(c1)Cl

STK844147
Synonyms: N~4~-benzyl-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4,6-triamine
Smiles: [O-][N+](=O)c1c(N)nc(nc1NCc1ccccc1)NCCCN1CCOCC1

STK550691
Synonyms: N,N'-bis(3-chloro-2,5,6-trifluoropyridin-4-yl)benzene-1,2-diamine
Smiles: Fc1nc(F)c(c(c1F)Nc1ccccc1Nc1c(F)c(F)nc(c1Cl)F)Cl

STK550697
Synonyms: 1-(5-methoxy-2-methyl-1H-indol-3-yl)-2-(3-methylpiperidin-1-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCCC(C1)C)c([nH]2)C

STK550699
Synonyms: (5Z)-5-(2,3-dimethoxybenzylidene)-3-(phenylamino)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)Nc1ccccc1

STK844149
Synonyms: ethyl2-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1N/C=C(\c1scc(n1)c1ccc2c(c1)OCO2)/C#N

STK844150
Synonyms: propan-2-yl5-{[(2-chlorophenyl)carbonyl]oxy}-2-methyl-1-benzofuran-3-carboxylate
Smiles: CC(OC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccccc1Cl)C

STK550702
Synonyms: 12-ethyl-9-(ethylsulfanyl)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclohexan]-7(12H)-one
Smiles: CCSc1nnc2n1c(=O)c1c(n2CC)c2ccccc2CC21CCCCC2

STK550710
Synonyms: (2E,5Z)-2-[(2,4-dichlorophenyl)imino]-5-(3-ethoxy-4-hydroxybenzylidene)-1,3-thiazolidin-4-one
Smiles: CCOc1cc(ccc1O)/C=C/1\S/C(=N/c2ccc(cc2Cl)Cl)/NC1=O

STK550712
Synonyms: 3-{[(E)-(3-fluorophenyl)methylidene]amino}-7,8-dimethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc2c(cc1OC)[nH]c1c2ncn(c1=O)/N=C/c1cccc(c1)F

STK844154
Synonyms: dipropan-2-yl[(2,4-dichlorophenyl)(phenylamino)methyl]phosphonate
Smiles: CC(OP(=O)(C(c1ccc(cc1Cl)Cl)Nc1ccccc1)OC(C)C)C

STK550723
Synonyms: 4-(4-methylphenyl)-1-[(naphthalen-2-ylmethyl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Cc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SCc1ccc2c(c1)cccc2

STK550726
Synonyms: (4E)-4-{[4-(dimethylamino)phenyl]imino}-5-hydroxy-2-(morpholin-4-yl)naphthalen-1(4H)-one
Smiles: CN(c1ccc(cc1)/N=C/1\C=C(N2CCOCC2)C(=O)c2c1c(O)ccc2)C

STK550728
Synonyms: 4-{(Z)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}-2,6-dimethoxyphenylacetate
Smiles: N#C/C(=C/c1cc(OC)c(c(c1)OC)OC(=O)C)/c1scc(n1)c1cccc(c1)Br

STK550742
Synonyms: (5Z)-2-[(3,4-dimethylphenyl)amino]-5-(4-hydroxy-3-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1cc(ccc1O)/C=C/1\SC(=NC1=O)Nc1ccc(c(c1)C)C

STK550743
Synonyms: prop-2-en-1-yl4-(2-chlorophenyl)-5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)OCC

STK550747
Synonyms: 5-cyano-6-({2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(4-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK550752
Synonyms: 3,3'-{sulfonylbis[(2-chlorobenzene-4,1-diyl)oxy]}bis[1-(dimethylamino)propan-2-ol]
Smiles: CN(CC(COc1ccc(cc1Cl)S(=O)(=O)c1ccc(c(c1)Cl)OCC(CN(C)C)O)O)C

STK550755
Synonyms: (5Z)-2-[(2,3-dichlorophenyl)amino]-5-(2-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1ccccc1/C=C/1\SC(=NC1=O)Nc1cccc(c1Cl)Cl

STK550759
Synonyms: N~4~-benzyl-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4,6-triamine
Smiles: C=CCNc1nc(NCc2ccccc2)c(c(n1)N)[N+](=O)[O-]

STK550765
Synonyms: 3-ethyl-2-[(4-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCn1c(SCc2ccc(cc2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK844159
Synonyms: (2Z)-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-[(2,4-difluorophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1F)F)/c1scc(n1)c1ccc(cc1Cl)Cl

STK550771
Synonyms: (2-chloro-5-nitrophenyl)[1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl]methanone
Smiles: CCOc1cc(ccc1OCC)CC1c2cc(OCC)c(cc2CCN1C(=O)c1cc(ccc1Cl)[N+](=O)[O-])OCC

STK844160
Synonyms: (5Z)-2-[(2,3-dimethylphenyl)amino]-5-(4-hydroxy-3-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1cc(ccc1O)/C=C/1\SC(=NC1=O)Nc1cccc(c1C)C

STK550774
Synonyms: prop-2-en-1-yl5-cyano-4-(furan-2-yl)-2-methyl-6-({2-[(4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK550775
Synonyms: N~4~-(4-chlorophenyl)-N~2~-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: Clc1ccc(cc1)Nc1nc(Nc2cccc(c2)C)nc(c1[N+](=O)[O-])N

STK844161
Synonyms: 2-{[3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)C1C(=C(SCC(=O)N)NC2=C1C(=O)CC(C2)(C)C)C#N

STK550776
Synonyms: 3-{[3-chloro-2,5-difluoro-6-(morpholin-4-yl)pyridin-4-yl]oxy}phenol
Smiles: Oc1cccc(c1)Oc1c(F)c(nc(c1Cl)F)N1CCOCC1

STK844164
Synonyms: N-(4-methylphenyl)-2-(pyridin-4-yl)quinazolin-4-amine
Smiles: Cc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccncc1

STK550778
Synonyms: (2Z)-[2-(4-ethoxyphenyl)hydrazinylidene][4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: CCOc1ccc(cc1)N/N=C(\c1scc(n1)c1cccc(c1)[N+](=O)[O-])/C#N

STK550779
Synonyms: 6-ethyl-4-(ethylsulfanyl)-6-methyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCSc1nc(SC)nc2c1c1CC(C)(CC)OCc1s2

STK550782
Synonyms: ethyl3-[({4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl}acetyl)amino]-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)(O)c1cccc(c1)C(F)(F)F)cc(c(c2)OC)OC

STK550785
Synonyms: 3-(2-methylpropyl)-2-(propylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(C)C)CCCC3

STK550788
Synonyms: (2E)-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile
Smiles: N#C/C(=C\c1ccccc1C(F)(F)F)/c1scc(n1)c1cccc(c1)OC

STK550790
Synonyms: 2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1cc(Cl)ccc1C)c([nH]2)C

STK550791
Synonyms: 2-amino-3-(piperidin-1-yl)naphthalene-1,4-dione
Smiles: NC1=C(N2CCCCC2)C(=O)c2c(C1=O)cccc2

STK550793
Synonyms: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl(diphenylphosphoryl)acetate
Smiles: O=C(CP(=O)(c1ccccc1)c1ccccc1)OCC(=O)c1ccc2c(c1)OCCO2

STK844167
Synonyms: (5Z)-3-[4-(diethylamino)phenyl]-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCN(c1ccc(cc1)N1C(=S)S/C(=C\C(=C\c2ccccc2)\C)/C1=O)CC

STK844168
Synonyms: 1-phenyl-4-[1-(prop-2-en-1-yl)-1H-benzimidazol-2-yl]pyrrolidin-2-one
Smiles: C=CCn1c(nc2c1cccc2)C1CC(=O)N(C1)c1ccccc1

STK801749
Synonyms: N-[1-(furan-2-yl)-3-methylbut-3-en-1-yl]-4-methoxyaniline
Smiles: COc1ccc(cc1)NC(c1ccco1)CC(=C)C

STK550798
Synonyms: 1-amino-N-benzyl-5-(morpholin-4-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)NCc1ccccc1

STK550799
Synonyms: 1-(2-chloro-10H-phenothiazin-10-yl)-3-(4-methylpiperazin-1-yl)propan-1-one
Smiles: CN1CCN(CC1)CCC(=O)N1c2ccccc2Sc2c1cc(Cl)cc2

STK844170
Synonyms: (5Z)-2-[(4-chlorophenyl)amino]-5-(3-ethoxy-4-hydroxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=NC1=O)Nc1ccc(cc1)Cl

STK844171
Synonyms: 4-[(morpholin-4-ylcarbonyl)amino]phenylmorpholine-4-carboxylate
Smiles: O=C(N1CCOCC1)Nc1ccc(cc1)OC(=O)N1CCOCC1

STK844172
Synonyms: N~2~-(furan-2-ylmethyl)-N~4~-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: COc1ccc(cc1)Nc1nc(NCc2ccco2)nc(c1[N+](=O)[O-])N

STK550815
Synonyms: benzyl4-(4-chlorophenyl)-5-cyano-2-methyl-6-[(2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C(F)(F)F)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C

STK550816
Synonyms: N-(4-methoxyphenyl)-5-nitro-2-(piperidin-1-yl)pyrimidine-4,6-diamine
Smiles: COc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCCCC1

STK550820
Synonyms: 4-{3-[3-(furan-2-yl)-1H-pyrazol-5-yl]-5-sulfanyl-4H-1,2,4-triazol-4-yl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)n1c(S)nnc1c1[nH]nc(c1)c1ccco1

STK550821
Synonyms: N~2~-(2,5-dimethoxyphenyl)-N~4~-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: COc1ccc(c(c1)Nc1nc(N)c(c(n1)Nc1cccc(c1)C)[N+](=O)[O-])OC

STK844173
Synonyms: N~2~-(2,5-dimethoxyphenyl)-N~4~-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: COc1ccc(c(c1)Nc1nc(N)c(c(n1)Nc1ccccc1F)[N+](=O)[O-])OC

STK844174
Synonyms: 2-(azepan-1-yl)-N-(4-methylphenyl)-5-nitropyrimidine-4,6-diamine
Smiles: Cc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCCCCC1

STK550835
Synonyms: ethyl2-{[(Z)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccccc2)/C#N)sc2c1CCCC2

STK550838
Synonyms: 1-(5-methoxy-2-methyl-1H-indol-3-yl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)c([nH]2)C

STK550840
Synonyms: 2-(azepan-1-yl)-N-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine
Smiles: Cc1cccc(c1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCCCCC1

STK550842
Synonyms: N-[(2-{[(1S,2S)-2-phenylcyclopropyl]carbonyl}hydrazinyl)carbonothioyl]thiophene-2-carboxamide
Smiles: S=C(NC(=O)c1cccs1)NNC(=O)[C@H]1C[C@@H]1c1ccccc1

STK550843
Synonyms: 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1cc2c(cc1OC)[nH]c1c2ncnc1N1CCN(CC1)c1ccccc1F

STK844175
Synonyms: 4-({(Z)-2-cyano-2-[4-(naphthalen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)benzamide
Smiles: N#C/C(=C/Nc1ccc(cc1)C(=O)N)/c1scc(n1)c1ccc2c(c1)cccc2

STK844176
Synonyms: (5Z)-3-(3-hydroxyphenyl)-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Oc1cccc(c1)N1C(=S)S/C(=C\c2cccs2)/C1=O

STK550849
Synonyms: 4-chloro-N-[3-(4-ethylpiperazin-1-yl)quinoxalin-2-yl]benzenesulfonamide
Smiles: CCN1CCN(CC1)c1nc2ccccc2nc1NS(=O)(=O)c1ccc(cc1)Cl

STK550853
Synonyms: N-cyclopentyl-2-(2-fluorophenyl)quinazolin-4-amine
Smiles: Fc1ccccc1c1nc(NC2CCCC2)c2c(n1)cccc2

STK550857
Synonyms: (2Z)-2-{1-[(4-methoxyphenyl)amino]ethylidene}-1-benzothiophen-3(2H)-one
Smiles: COc1ccc(cc1)N/C(=C/1\Sc2c(C1=O)cccc2)/C

STK550858
Synonyms: ethyl3-({3-[4-(ethoxycarbonyl)piperidin-1-yl]propanoyl}amino)-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CCC(=O)Nc1c([nH]c2c1cc(OC)cc2)C(=O)OCC

STK844181
Synonyms: 4-{(Z)-2-cyano-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]ethenyl}phenylacetate
Smiles: N#C/C(=C/c1ccc(cc1)OC(=O)C)/c1scc(n1)c1cccc(c1)OC

STK550862
Synonyms: 5-bromo-N'-[(E)-1H-indol-3-ylmethylidene]-3-phenyl-1H-indole-2-carbohydrazide
Smiles: Brc1ccc2c(c1)c(c1ccccc1)c([nH]2)C(=O)N/N=C/c1c[nH]c2c1cccc2

STK844183
Synonyms: 11-methyl-1,2,3,4,4a,12a-hexahydrodibenzo[d,g][1,6,3]oxathiazocin-6(7H)-one
Smiles: O=C1OC2CCCCC2Sc2c(N1)cccc2C

STK550863
Synonyms: 3-[(8-bromo-5H-pyrimido[5,4-b]indol-4-yl)amino]propan-1-ol
Smiles: OCCCNc1ncnc2c1[nH]c1c2cc(cc1)Br

STK550868
Synonyms: N-({2-[(2,4-dihydroxyphenyl)carbonyl]hydrazinyl}carbonothioyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
Smiles: S=C(NC(=O)c1c(C)onc1c1ccccc1)NNC(=O)c1ccc(cc1O)O

STK844185
Synonyms: (2Z)-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1ccc(cc1C)C

STK550873
Synonyms: 2-chloro-7-methyl-3-[1-(methylsulfonyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-5-yl]quinoline
Smiles: Cc1ccc2c(c1)nc(c(c2)C1CC(=NN1S(=O)(=O)C)c1cccs1)Cl

STK550880
Synonyms: 1-(1-methoxycyclohexyl)-3-phenylpropane-1,3-dione
Smiles: COC1(CCCCC1)C(=O)CC(=O)c1ccccc1

STK550882
Synonyms: (3aR,4S,8aS,8bS)-2-(4-chlorophenyl)-4-(phenylcarbonyl)hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@H]1N([C@@H]2C(=O)c2ccccc2)CCC1

STK550884
Synonyms: 2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxy-4-(morpholin-4-yl)quinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCOCC1)c1ccc(c(c1)OC)OC

STK550896
Synonyms: 2-[(2-ethyl-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)N)c2c(n1)sc1c2CCC1

STK844187
Synonyms: (2Z)-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl][2-(4-chlorophenyl)hydrazinylidene]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)Cl)/c1scc(n1)c1ccc2c(c1)OCO2

STK550906
Synonyms: ethyl1-(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)c1ncnc2c1[nH]c1c2cc(cc1)Cl

STK550908
Synonyms: (5Z)-2-[(3,4-dimethylphenyl)amino]-5-(3-ethoxy-4-hydroxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=NC1=O)Nc1ccc(c(c1)C)C

STK550911
Synonyms: ethyl2-{[(Z)-2-cyano-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}ethenyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc(cc2)CC(C)C)/C#N)sc2c1CCCC2

STK550912
Synonyms: N-[(5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-4-nitrobenzamide
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)[N+](=O)[O-]

STK844189
Synonyms: benzyl5-cyano-6-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)NC2CCCCC2)NC(=C(C1c1ccco1)C(=O)OCc1ccccc1)C

STK844190
Synonyms: 3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-4H-chromen-7-yl4-chlorobenzoate
Smiles: Clc1ccc(cc1)C(=O)Oc1ccc2c(c1C)occ(c2=O)c1nc2c(s1)cccc2

STK550913
Synonyms: 2-methoxy-6-{4-[(4-methylphenyl)amino]quinazolin-2-yl}phenol
Smiles: COc1cccc(c1O)c1nc(Nc2ccc(cc2)C)c2c(n1)cccc2

STK550914
Synonyms: 3-{(E)-[2-({[3-(ethoxycarbonyl)-1,2-dimethyl-1H-indol-5-yl]oxy}acetyl)hydrazinylidene]methyl}-1H-indole-7-carboxylicacid
Smiles: CCOC(=O)c1c(C)n(c2c1cc(OCC(=O)N/N=C/c1c[nH]c3c1cccc3C(=O)O)cc2)C

STK550916
Synonyms: 4-fluoro-N'-[(3Z)-2-oxo-1-{[(1R,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-1,2-dihydro-3H-indol-3-ylidene]benzohydrazide
Smiles: Fc1ccc(cc1)C(=O)N/N=C\1/c2ccccc2N(C1=O)CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

STK844191
Synonyms: (5Z)-3-[4-(diethylamino)phenyl]-2-thioxo-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-4-one
Smiles: CCN(c1ccc(cc1)N1C(=S)S/C(=C\c2cc(OC)c(c(c2)OC)OC)/C1=O)CC

STK550918
Synonyms: 4-[(2-methyl-5-phenyl-1H-pyrrol-1-yl)methyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)Cn1c(C)ccc1c1ccccc1

STK844192
Synonyms: 1-(methylsulfonyl)-5-phenyl-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazole
Smiles: CS(=O)(=O)N1N=C(CC1c1ccccc1)c1cccs1

STK550923
Synonyms: 5-[(2,6-dimethylmorpholin-4-yl)carbonyl]-4,6-dimethyl-2H-pyran-2-one
Smiles: CC1OC(C)CN(C1)C(=O)c1c(C)cc(=O)oc1C

STK550928
Synonyms: 2-[(E)-(2,3-dihydro-1,4-benzodioxin-6-ylimino)methyl]-6-nitrophenol
Smiles: [O-][N+](=O)c1cccc(c1O)/C=N/c1ccc2c(c1)OCCO2

STK844198
Synonyms: N'-[(E)-(3-hydroxyphenyl)methylidene]thiophene-2-carbohydrazide
Smiles: Oc1cccc(c1)/C=N/NC(=O)c1cccs1

STK844200
Synonyms: N-{(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-3-nitrobenzamide
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1cccc(c1)[N+](=O)[O-]

STK844201
Synonyms: 3-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-8-nitro-2H-chromen-2-one
Smiles: O=c1oc2c(cc1c1scc(n1)c1ccc(c(c1)Cl)Cl)cccc2[N+](=O)[O-]

STK550930
Synonyms: 5-chloro-N'-[(E)-(4-hydroxyphenyl)methylidene]-3-phenyl-1H-indole-2-carbohydrazide
Smiles: Oc1ccc(cc1)/C=N/NC(=O)c1[nH]c2c(c1c1ccccc1)cc(cc2)Cl

STK844202
Synonyms: methyl4-{(Z)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}benzoate
Smiles: N#C/C(=C/c1ccc(cc1)C(=O)OC)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK550937
Synonyms: 2-[(7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(F)(F)F)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK844203
Synonyms: ethyl5-cyano-4-(furan-2-yl)-6-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)C1=C(NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1)C)c1ccccc1

STK550942
Synonyms: (9E)-9-(4-methoxybenzylidene)-3,5-bis(4-methoxyphenyl)-7-methyl-6,7,8,9-tetrahydro-5H-pyrido[4,3-d][1,3]thiazolo[3,2-a]pyrimidine
Smiles: COc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)OC)/C(=C/c1ccc(cc1)OC)/CN(C2)C

STK550943
Synonyms: 3-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-2H-pyran-5-carboxamide
Smiles: Cc1onc(c1)NC(=O)c1coc(=O)c(c1)Br

STK550944
Synonyms: ethyl3-(1,3-benzothiazol-2-yl)-4-oxo-7-(propanoyloxy)-4H-chromene-2-carboxylate
Smiles: CCOC(=O)c1oc2cc(ccc2c(=O)c1c1nc2c(s1)cccc2)OC(=O)CC

STK550950
Synonyms: 4-(2,4-difluorophenyl)-2-methylcyclohex-2-en-1-one
Smiles: Fc1ccc(c(c1)F)C1CCC(=O)C(=C1)C

STK550951
Synonyms: N~4~-(4-chlorophenyl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4,6-triamine
Smiles: C=CCNc1nc(Nc2ccc(cc2)Cl)c(c(n1)N)[N+](=O)[O-]

STK550952
Synonyms: 5-oxo-5-[3-phenyl-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]pentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1cccs1)c1ccccc1

STK550955
Synonyms: 2-[4-(4-fluorophenyl)piperazin-1-yl]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1ccc(cc1)F)c([nH]2)C

STK550956
Synonyms: 2-[(5Z)-5-(2-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-phenylpropanoicacid
Smiles: COc1ccccc1/C=C/1\SC(=S)N(C1=O)C(C(=O)O)Cc1ccccc1

STK844207
Synonyms: 3-(1,3-benzothiazol-2-yl)-2-(ethoxycarbonyl)-4-oxo-4H-chromen-7-ylmorpholine-4-carboxylate
Smiles: CCOC(=O)c1oc2cc(ccc2c(=O)c1c1nc2c(s1)cccc2)OC(=O)N1CCOCC1

STK844208
Synonyms: 3-(1-benzofuran-2-yl)-1-ethoxyquinoxalin-2(1H)-one4-oxide
Smiles: CCOn1c(=O)c(c2cc3c(o2)cccc3)[n+](c2c1cccc2)[O-]

STK550963
Synonyms: 4-bromo-N-{(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzamide
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)Br

STK844209
Synonyms: benzyl5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)OCc1ccccc1)c1ccco1

STK550974
Synonyms: tert-butyl(8R,8aS,11aR)-10-(3-fluorophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-8-carboxylate
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=N1)C(=O)OC(C)(C)C

STK550982
Synonyms: 2-imino-1-(4-methoxybenzyl)-3-[(4-methylphenyl)sulfonyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Smiles: COc1ccc(cc1)Cn1c2nc3ccccn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccc(cc1)C

STK550992
Synonyms: 4-{(Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}phenylacetate
Smiles: N#C/C(=C/c1ccc(cc1)OC(=O)C)/c1scc(n1)c1ccc(cc1)Br

STK844211
Synonyms: 2-[3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione
Smiles: OC(CN1C(=O)c2c(C1=O)cccc2)CN1C(=O)NC(C1=O)(C)C

STK844213
Synonyms: (2E)-3-[(4-bromo-2-fluorophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1F)Br)/c1scc(n1)c1ccc(cc1)CC(C)C

STK551003
Synonyms: 2-(methylsulfanyl)-4-[(naphthalen-2-ylmethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: CSc1nc(SCc2ccc3c(c2)cccc3)c2c(n1)sc1c2CCCC1

STK844214
Synonyms: ethyl3-(1,3-benzothiazol-2-yl)-7-[(2,2-dimethylpropanoyl)oxy]-4-oxo-4H-chromene-2-carboxylate
Smiles: CCOC(=O)c1oc2cc(ccc2c(=O)c1c1nc2c(s1)cccc2)OC(=O)C(C)(C)C

STK551007
Synonyms: (2Z)-3-[(3,4-difluorophenyl)amino]-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(c(c1)F)F)/c1scc(n1)c1ccccc1

STK551008
Synonyms: (2E)-[2-(4-fluorophenyl)hydrazinylidene][4-(naphthalen-1-yl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: N#C/C(=N\Nc1ccc(cc1)F)/c1scc(n1)c1cccc2c1cccc2

STK551010
Synonyms: (5Z)-2-[(2-chlorophenyl)amino]-5-(3-fluorobenzylidene)-1,3-thiazol-4(5H)-one
Smiles: Fc1cccc(c1)/C=C/1\SC(=NC1=O)Nc1ccccc1Cl

STK551011
Synonyms: 7,8-dimethoxy-3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc2c(cc1OC)[nH]c1c2ncn(c1=O)CCN1CCCCC1

STK551016
Synonyms: [(5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl](phenyl)aceticacid
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)C(=O)O

STK551017
Synonyms: 2-{4-[(2-hydroxyethyl)(methyl)amino]quinazolin-2-yl}-6-methoxyphenol
Smiles: OCCN(c1nc(nc2c1cccc2)c1cccc(c1O)OC)C

STK551018
Synonyms: (2Z)-[2-(4-bromophenyl)hydrazinylidene][4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)Br)/c1scc(n1)c1ccc(cc1)F

STK551020
Synonyms: 1-chloro-8-(diethylcarbamoyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-4-carboxylicacid
Smiles: CCN(C(=O)c1ccc2c(c1)C1C(Cl)C(CC1C(N2)C(=O)O)Sc1ccccc1[N+](=O)[O-])CC