FULL DB

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

STK854232
Synonyms: 2-methyl-4-{2-oxo-2-[4-(propan-2-yloxy)phenyl]ethyl}-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CC(Oc1ccc(cc1)C(=O)CN1C(=O)C(C)Oc2c(C1=O)cccc2)C

STK854233
Synonyms: (4E)-5-(3,4-dichlorophenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]-1-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)/C(=C\1/C(c2ccc(c(c2)Cl)Cl)N(C(=O)C1=O)c1ccccn1)/O

STK854234
Synonyms: 3-hydroxy-4-(4-nitrophenyl)-1-(propan-2-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: O=C1CSC(c2c(N1)n(nc2O)C(C)C)c1ccc(cc1)[N+](=O)[O-]

STK854235
Synonyms: N-(4-{[1-(4-bromophenyl)-1H-tetrazol-5-yl]methoxy}phenyl)benzamide
Smiles: Brc1ccc(cc1)n1nnnc1COc1ccc(cc1)NC(=O)c1ccccc1

STK854236
Synonyms: 1-(4-fluorophenyl)-6-methoxy-2-(1,3-thiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)c1nccs1)c1ccc(cc1)F

STK854238
Synonyms: 3-(1,3-benzothiazol-2-yl)-N-ethyl-N-(3-methylphenyl)pyrazine-2-carboxamide
Smiles: CCN(C(=O)c1nccnc1c1nc2c(s1)cccc2)c1cccc(c1)C

STK854240
Synonyms: 6-methoxy-2-[2-(morpholin-4-yl)ethyl]-1-(thiophen-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)CCN1CCOCC1)c1cccs1

STK854241
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
Smiles: COc1cc(CCNC(=O)c2sc(nc2C)c2ccccc2)ccc1OC

STK854242
Synonyms: 1-(1,4-diphenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl)ethanone
Smiles: CC(=O)c1c(c2ccccc2)c2c3n1cc(n3CCCC2)c1ccccc1

STK854244
Synonyms: methyl4-{3-[(E)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=NC(=NC1=O)S)O

STK854246
Synonyms: 4-[2-(4-fluorophenyl)-2-oxoethyl]-2-phenyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: Fc1ccc(cc1)C(=O)CN1C(=O)C(Oc2c(C1=O)cccc2)c1ccccc1

STK854248
Synonyms: 2-{7-[(2E)-but-2-en-1-yl]-3,9-dimethyl-6,8-dioxo-6,7,8,9-tetrahydro[1,2,4]triazino[3,4-f]purin-1(4H)-yl}acetamide
Smiles: C/C=C/Cn1c(=O)n(C)c2c(c1=O)n1CC(=NN(c1n2)CC(=O)N)C

STK854250
Synonyms: (4E)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-[3-(1H-imidazol-1-yl)propyl]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccccn1)CCCn1cncc1)/O

STK854251
Synonyms: N-(4-{[1-(4-bromophenyl)-1H-tetrazol-5-yl]methoxy}phenyl)propanamide
Smiles: CCC(=O)Nc1ccc(cc1)OCc1nnnn1c1ccc(cc1)Br

STK854253
Synonyms: 1-(azepan-1-yl)-2-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)ethanone
Smiles: O=C(N1CCCCCC1)Cc1nn2c(n1)nc(c(c2C)Cl)C

STK854254
Synonyms: 2-{2-[(E)-2-(4,6-dihydroxy-5-nitropyrimidin-2-yl)ethenyl]phenoxy}-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)COc1ccccc1/C=C/c1nc(O)c(c(n1)O)[N+](=O)[O-]

STK854255
Synonyms: {[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetonitrile
Smiles: CCOc1ccc(cc1)n1c(SCC#N)nc2c(c1=O)c1CCCCc1s2

STK854256
Synonyms: N-[2-(furan-2-yl)-2-(morpholin-4-yl)ethyl]-3,5-dimethyl-1-benzofuran-2-carboxamide
Smiles: Cc1ccc2c(c1)c(C)c(o2)C(=O)NCC(c1ccco1)N1CCOCC1

STK854257
Synonyms: 3,3'-[(3-chlorophenyl)methanediyl]bis(4-hydroxy-1,6-dimethylpyridin-2(1H)-one)
Smiles: Clc1cccc(c1)C(c1c(O)cc(n(c1=O)C)C)c1c(O)cc(n(c1=O)C)C

STK854258
Synonyms: (5E)-3-(1,3-benzodioxol-5-yl)-6-hydroxy-5-{[5-(phenylsulfanyl)furan-2-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\c2ccc(o2)Sc2ccccc2)/C(=O)N1c1ccc2c(c1)OCO2

STK854259
Synonyms: 2-[8-(3-hydroxypropyl)-1,6,7-trimethyl-2,4-dioxo-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]acetamide
Smiles: OCCCn1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CC(=O)N

STK854260
Synonyms: [3-(1,3-benzothiazol-2-yl)pyrazin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: O=C(c1nccnc1c1nc2c(s1)cccc2)N1CCc2c(C1)cccc2

STK854261
Synonyms: 6-benzyl-2-(4-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: Clc1ccc(cc1)c1nn2c(c1)nc(c(c2O)Cc1ccccc1)C

STK854262
Synonyms: (5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-6-hydroxy-2-sulfanylpyrimidin-4(5H)-one
Smiles: SC1=NC(=O)/C(=C\c2cc(n(c2C)c2ccc(cc2)C)C)/C(=N1)O

STK854263
Synonyms: 6-hydroxy-1'-methyl-6'-nitro-2-sulfanyl-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one
Smiles: SC1=NC(=O)C2(C(=N1)O)CN(C)c1c(C2)cc(cc1)[N+](=O)[O-]

STK854265
Synonyms: (4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1OC)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854266
Synonyms: 2-{[3-cyano-4,6-di(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-[(2E)-4-methyl-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: N#Cc1c(SCC(=O)/N=c\2/scc([nH]2)C)nc(cc1c1cccs1)c1cccs1

STK854267
Synonyms: 2-{[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl}-5,7-dimethyl-4H-chromen-4-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)c1cc(=O)c2c(o1)cc(cc2C)C

STK854268
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2cccc(c2)OC)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854270
Synonyms: ethyl4-[(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)carbamoyl]piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)Nc1sc2c(c1C#N)CC(OC2)(C)C

STK854273
Synonyms: 6-chloro-2-[5-(2-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-phenylquinazoline
Smiles: COc1ccccc1C1CC(=NN1c1nc2ccc(cc2c(n1)c1ccccc1)Cl)c1cccs1

STK854274
Synonyms: 3-(2-chlorobenzyl)-1-methyl-9-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Clc1ccccc1Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)CCc1ccccc1

STK854276
Synonyms: 2-(6-bromo-2-methoxynaphthalen-1-yl)-N-cyclopentylacetamide
Smiles: COc1ccc2c(c1CC(=O)NC1CCCC1)ccc(c2)Br

STK854277
Synonyms: 3-chloro-N-(5-fluoro-9-oxo-9H-xanthen-3-yl)benzamide
Smiles: Clc1cccc(c1)C(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1F

STK854280
Synonyms: N-(3-acetylphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1(6H)-yl]acetamide
Smiles: O=C(Cn1nc(ccc1=O)c1ccco1)Nc1cccc(c1)C(=O)C

STK854281
Synonyms: 1-(4-chlorophenyl)-6-methoxy-2-(1,3-thiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)c1nccs1)c1ccc(cc1)Cl

STK854282
Synonyms: propan-2-yl4-(4-hydroxy-3-methoxyphenyl)-2-methyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: COc1cc(ccc1O)C1C(=C(C)N=c2n1c1ccccc1[nH]2)C(=O)OC(C)C

STK854283
Synonyms: 1,6,7-trimethyl-3-(2-methylprop-2-en-1-yl)[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1c(n2)oc(c1C)C

STK854286
Synonyms: (4E)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Cc1onc(c1)N1C(=O)C(=O)/C(=C(\c2ccc(o2)C)/O)/C1c1ccc(cc1)[N+](=O)[O-]

STK854287
Synonyms: 2-(1,7-dimethyl-2,4-dioxo-1,4-dihydro[1,3]oxazolo[2,3-f]purin-3(2H)-yl)acetamide
Smiles: NC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(oc1n2)C

STK854288
Synonyms: quinolin-8-yl4,7,7-trimethyl-2,3-dioxobicyclo[2.2.1]heptane-1-carboxylate
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)Oc1cccc2c1nccc2

STK854290
Synonyms: (4E)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Cc1onc(c1)N1C(=O)C(=O)/C(=C(\c2cccs2)/O)/C1c1cccc(c1)[N+](=O)[O-]

STK854291
Synonyms: (4E)-4-[(4-bromophenyl)(hydroxy)methylidene]-5-(3-hydroxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Oc1cccc(c1)C1/C(=C(/c2ccc(cc2)Br)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854292
Synonyms: (5E)-1-(2-ethylphenyl)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCc1ccccc1N1C(=NC(=O)/C(=C\c2ccc(o2)c2ccc(cc2)F)/C1=O)S

STK854293
Synonyms: N-[4-(acetylamino)phenyl]-1-(4-chlorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: CC(=O)Nc1ccc(cc1)NC(=O)c1nn(ccc1=O)c1ccc(cc1)Cl

STK854294
Synonyms: 3-(2-fluorobenzyl)-1,9-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Fc1ccccc1Cn1c(=O)c2n3CCCN(c3nc2n(c1=O)C)C

STK854296
Synonyms: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N'-(furan-2-ylmethyl)ethanediamide
Smiles: O=C(C(=O)Nc1sc2c(c1C(=O)N)CCCC2)NCc1ccco1

STK854299
Synonyms: 1,6,7-trimethyl-3-[2-(morpholin-4-yl)ethyl][1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: O=c1n(CCN2CCOCC2)c(=O)c2c(n1C)nc1n2c(C)c(o1)C

STK854301
Synonyms: (4E)-5-(3-chlorophenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]-1-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)c1ccccn1)/O

STK854302
Synonyms: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-phenyl-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Smiles: O=C1N(c2nccs2)C(/C(=C(/c2cc3c(o2)cccc3)\O)/C1=O)c1ccccc1

STK854306
Synonyms: (5E)-3-(1,3-benzodioxol-5-yl)-6-hydroxy-5-(thiophen-3-ylmethylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\c2cscc2)/C(=O)N1c1ccc2c(c1)OCO2

STK854309
Synonyms: 4-[2-(5-methyl-1-phenyl-1H-pyrazol-4-yl)-2-oxoethyl]-2-(propan-2-yl)-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CC(C1Oc2ccccc2C(=O)N(C1=O)CC(=O)c1cnn(c1C)c1ccccc1)C

STK854310
Synonyms: 4-[2-(2-methoxyphenyl)-2-oxoethyl]-2-methyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: COc1ccccc1C(=O)CN1C(=O)C(C)Oc2c(C1=O)cccc2

STK854311
Synonyms: 2,3-dimethyl-N-(thiophen-2-ylmethyl)-1H-indole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)NCc1cccs1

STK854312
Synonyms: 1,7,8-trimethyl-3-[(2E)-3-phenylprop-2-en-1-yl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: O=c1n(C/C=C/c2ccccc2)c(=O)c2c(n1C)nc1n2cc(n1C)C

STK854313
Synonyms: methyl(1-methyl-2,4-dioxo-7-phenyl-1,4-dihydro[1,3]oxazolo[2,3-f]purin-3(2H)-yl)acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(oc1n2)c1ccccc1

STK854314
Synonyms: 2-[(naphthalen-1-yloxy)methyl]-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclopentane]
Smiles: c1ccc2c(c1)CC1(c3c2ncn2c3nc(n2)COc2cccc3c2cccc3)CCCC1

STK854316
Synonyms: methyl(1,7-dimethyl-2,4-dioxo-1,4-dihydro[1,3]oxazolo[2,3-f]purin-3(2H)-yl)acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(oc1n2)C

STK854318
Synonyms: N-(5-chloro-9-oxo-9H-xanthen-3-yl)benzamide
Smiles: O=C(c1ccccc1)Nc1ccc2c(c1)oc1c(c2=O)cccc1Cl

STK854321
Synonyms: N-(5-chloro-9-oxo-9H-xanthen-3-yl)thiophene-2-carboxamide
Smiles: O=C(c1cccs1)Nc1ccc2c(c1)oc1c(c2=O)cccc1Cl

STK854322
Synonyms: (2Z)-2-(2,5-dimethoxybenzylidene)-4-methyl-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1ccc(cc1/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCN(CC1)C)[O-])OC

STK854323
Synonyms: (4E)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-5-(3-methoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854324
Synonyms: 3-(2-fluorobenzyl)-1,7-dimethyl[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: Cc1cn2c(o1)nc1c2c(=O)n(Cc2ccccc2F)c(=O)n1C

STK854327
Synonyms: 8-(4-ethylphenyl)-3-(2-methoxyethyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)CC

STK854328
Synonyms: methyl2'-amino-6'-(2-methoxyethyl)-1,7'-dimethyl-2,5'-dioxo-1,2,5',6'-tetrahydrospiro[indole-3,4'-pyrano[3,2-c]pyridine]-3'-carboxylate
Smiles: COCCn1c(C)cc2c(c1=O)C1(C(=C(O2)N)C(=O)OC)C(=O)N(c2c1cccc2)C

STK854330
Synonyms: (5E)-3-(3-bromophenyl)-6-hydroxy-5-{4-[(5-nitropyridin-2-yl)oxy]benzylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: Brc1cccc(c1)N1C(=O)N=C(/C(=C\c2ccc(cc2)Oc2ccc(cn2)[N+](=O)[O-])/C1=O)O

STK854331
Synonyms: 2-amino-N-(3-methoxypropyl)-1-{[(E)-(4-methylphenyl)methylidene]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)C

STK854334
Synonyms: 2,3-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]-1H-indole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)NCCc1ccc(cc1)S(=O)(=O)N

STK854336
Synonyms: 4-(4-methylbenzyl)-N-{(E)-[4-(trifluoromethyl)phenyl]methylidene}piperazin-1-amine
Smiles: Cc1ccc(cc1)CN1CCN(CC1)/N=C/c1ccc(cc1)C(F)(F)F

STK854337
Synonyms: 5-[(2-methoxyphenoxy)methyl]-1-[3-(trifluoromethyl)phenyl]-1H-tetrazole
Smiles: COc1ccccc1OCc1nnnn1c1cccc(c1)C(F)(F)F

STK854338
Synonyms: (5E)-1-(3-methylphenyl)-2-sulfanyl-5-[(1,2,5-trimethyl-1H-pyrrol-3-yl)methylidene]pyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cccc(c1)N1C(=NC(=O)/C(=C\c2cc(n(c2C)C)C)/C1=O)S

STK854340
Synonyms: 1-[(2Z)-5-[2-(benzylsulfanyl)phenyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-methylphenyl)urea
Smiles: Cc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)c1ccccc1SCc1ccccc1

STK854341
Synonyms: 4-hydroxy-6-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-2-phenyl-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: Cc1ccnc(n1)SCc1cc(O)c2c(n1)[nH]n(c2=O)c1ccccc1

STK854345
Synonyms: (2Z)-2-(2,4-dimethoxybenzylidene)-4-methyl-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1cc(OC)ccc1/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCN(CC1)C)[O-]

STK854346
Synonyms: 4-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-2-(propan-2-yl)-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: COc1ccc(cc1C(=O)CN1C(=O)C(Oc2c(C1=O)cccc2)C(C)C)C

STK854348
Synonyms: 8-(4-ethylphenyl)-1-methyl-3-(prop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: C=CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)CC

STK854350
Synonyms: (2E)-2-(1,3-benzothiazol-2-yl)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc2OCOc2cc1Br)/c1nc2c(s1)cccc2

STK854351
Synonyms: 1,7-dimethyl-8-[2-(morpholin-4-yl)ethyl]-3-(2-oxopropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)CCN1CCOCC1)C

STK854352
Synonyms: methyl[9-(4-fluorobenzyl)-4-methyl-2-oxo-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-3-yl]acetate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)ccc1c2CN(CO1)Cc1ccc(cc1)F

STK854353
Synonyms: 2-(benzylamino)-6-methyl-3-(3,4,5-trimethoxyphenyl)-4H-furo[3,2-c]pyran-4-one
Smiles: COc1cc(cc(c1OC)OC)c1c(NCc2ccccc2)oc2c1c(=O)oc(c2)C

STK854354
Synonyms: N-(2-{2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]tetrahydro-2H-pyran-4-yl}ethyl)-4-methoxyaniline
Smiles: COc1ccc(cc1)NCCC1(CCOC(C1)(C)C)c1cccc(c1)C(F)(F)F

STK854356
Synonyms: (4E)-4-[(4-fluorophenyl)(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-[4-(propan-2-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1c1noc(c1)C)C

STK854358
Synonyms: N-[4-(dimethylsulfamoyl)phenyl]-2-(4-fluorophenyl)acetamide
Smiles: CN(S(=O)(=O)c1ccc(cc1)NC(=O)Cc1ccc(cc1)F)C

STK854361
Synonyms: 8-(butan-2-yl)-1,3,6,7-tetramethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCC(n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)C)C

STK854362
Synonyms: (4E)-5-(furan-2-yl)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)Cc1cccnc1)/O)C

STK854364
Synonyms: 4-methyl-N-(2-methylpropyl)-2-phenyl-1,3-thiazole-5-carboxamide
Smiles: CC(CNC(=O)c1sc(nc1C)c1ccccc1)C

STK854365
Synonyms: N-(2-chlorophenyl)-1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Fc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1ccccc1Cl

STK854366
Synonyms: 5,6-dimethyl-2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: C=CCn1c(SCC(=O)c2cccs2)nc2c(c1=O)c(C)c(s2)C

STK854368
Synonyms: (4E)-5-(2,3-dimethoxyphenyl)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-[3-(1H-imidazol-1-yl)propyl]pyrrolidine-2,3-dione
Smiles: COc1c(OC)cccc1C1N(CCCn2cncc2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC)/O

STK854370
Synonyms: 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SCC(=O)c2ccc(cc2)F)nc2c(c1=O)c1CCCc1s2

STK854372
Synonyms: 3-benzyl-8-[3-(1H-imidazol-1-yl)propyl]-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cn1c(=O)n(Cc2ccccc2)c(=O)c2c1nc1n2cc(n1CCCn1cncc1)C

STK854373
Synonyms: 2-amino-1-{[(E)-(4-fluorophenyl)methylidene]amino}-N-(tetrahydrofuran-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Fc1ccc(cc1)/C=N/n1c2nc3ccccc3nc2c(c1N)C(=O)NCC1CCCO1

STK854375
Synonyms: N-(3-chloro-4-methylphenyl)-N'-{[4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl]methyl}ethanediamide
Smiles: COc1ccc(cc1)C1(CCOCC1)CNC(=O)C(=O)Nc1ccc(c(c1)Cl)C

STK854379
Synonyms: (2,3-dimethyl-1H-indol-5-yl)[4-(4-fluorophenyl)piperazin-1-yl]methanone
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc2c(c1)c(C)c([nH]2)C

STK854380
Synonyms: (2Z)-7-[(dimethylammonio)methyl]-2-(furan-2-ylmethylidene)-4-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: C[NH+](Cc1c([O-])cc(c2c1O/C(=C\c1ccco1)/C2=O)C)C

STK854383
Synonyms: 7-(4-fluorophenyl)-6-phenyl-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Fc1ccc(cc1)C1C2=C(Nc3n1ncn3)c1c(OC2c2ccccc2)cccc1

STK854386
Synonyms: 1-(4-bromophenyl)-5-[(3-methylphenoxy)methyl]-1H-tetrazole
Smiles: Brc1ccc(cc1)n1nnnc1COc1cccc(c1)C

STK854392
Synonyms: 1-benzyl-3-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-1-(2-hydroxyethyl)urea
Smiles: OCCN(C(=O)Nc1sc2c(c1C#N)CC(OC2)(C)C)Cc1ccccc1

STK854393
Synonyms: N-[(2Z)-3-(2-chlorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: O=C(C(C)C)/N=C/1\SC2C(N1Cc1ccccc1Cl)CS(=O)(=O)C2

STK854394
Synonyms: 8-(2-hydroxyethyl)-1,7-dimethyl-3-(3-phenylpropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCCc1ccccc1

STK854395
Synonyms: (4E)-5-(4-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854396
Synonyms: (5E)-5-[4-(diethylamino)-2-methoxybenzylidene]-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CCN(c1ccc(c(c1)OC)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)CC

STK854398
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: Cc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)C(C)C

STK854405
Synonyms: 5-benzyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-c]pyrimidine
Smiles: c1ccc(cc1)Cc1nc2sc3c(c2c2n1nnn2)CCCC3

STK854406
Synonyms: (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-[3-(1H-imidazol-1-yl)propyl]-5-(pyridin-4-yl)pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CCCn1ccnc1)/O)C

STK854407
Synonyms: methyl[9-(3-chloro-2-methylphenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1C)Cl

STK854408
Synonyms: N-(3-methoxyphenyl)-1-oxo-1H-isochromene-3-carboxamide
Smiles: COc1cccc(c1)NC(=O)c1cc2ccccc2c(=O)o1

STK854409
Synonyms: (4E)-5-(4-chlorophenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)C1/C(=C(/c2ccco2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854410
Synonyms: 6-iodo-3-(2-nitrophenyl)-2-[(E)-2-(pyridin-3-yl)ethenyl]quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1cccnc1)c1ccccc1[N+](=O)[O-]

STK854411
Synonyms: 2-{[2-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-d]pyrimidin-4-yl]amino}ethanol
Smiles: OCCNc1nc(SC)nc2c1sc1c2CCCC1

STK854412
Synonyms: 1,6,7-trimethyl-3-(2-methylpropyl)-8-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(Cn1c(=O)c2n3c(C)c(n(c3nc2n(c1=O)C)CCN1CCOCC1)C)C

STK854413
Synonyms: N-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-2-oxo-2-(pyrrolidin-1-yl)acetamide
Smiles: N#Cc1c(NC(=O)C(=O)N2CCCC2)sc2c1CC(C)(C)OC2

STK854414
Synonyms: 1,3-dimethyl-5-phenyl-6-(quinolin-8-yl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: O=c1c2c(c3ccccc3)n(cc2n(c(=O)n1C)C)c1cccc2c1nccc2

STK854415
Synonyms: (2Z)-4-methyl-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2-(2,3,4-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1c(ccc(c1OC)OC)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCN(CC1)C)[O-]

STK854416
Synonyms: 2-ethoxy-3-methoxy-N-[(4-phenyltetrahydro-2H-pyran-4-yl)methyl]benzamide
Smiles: CCOc1c(OC)cccc1C(=O)NCC1(CCOCC1)c1ccccc1

STK854417
Synonyms: 1-(3-methoxyphenyl)-3-[(2Z)-5-(1-phenoxyethyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: COc1cccc(c1)NC(=O)/N=c\1/[nH]nc(s1)C(Oc1ccccc1)C

STK854418
Synonyms: N-(3-acetylphenyl)-2-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide
Smiles: O=C(Cc1nn2c(n1)nc(c(c2C)Cl)C)Nc1cccc(c1)C(=O)C

STK854419
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(2,3-dimethoxyphenyl)-1-[3-(1H-imidazol-1-yl)propyl]pyrrolidine-2,3-dione
Smiles: COc1cccc(c1OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CCCn1ccnc1

STK854420
Synonyms: 8-(2-methoxyethyl)-1,7-dimethyl-3-(3-methylbutyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STK854421
Synonyms: (2E)-3-(4-benzylpiperazin-1-yl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide
Smiles: COc1ccc(cc1)NC(=O)/C(=C/N1CCN(CC1)Cc1ccccc1)/C#N

STK854422
Synonyms: (5E)-1-(4-chlorophenyl)-5-{[1-(3,5-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C\c2cc(n(c2C)c2cc(C)cc(c2)C)C)/C1=O)S

STK854423
Synonyms: (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-[3-(1H-imidazol-1-yl)propyl]-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)CCCn1ccnc1)/O)C

STK854424
Synonyms: (2Z)-7-[(dimethylammonio)methyl]-2-[4-(methoxycarbonyl)benzylidene]-4-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+](C)C)[O-]

STK854426
Synonyms: 4-(2-{2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]tetrahydro-2H-pyran-4-yl}ethyl)morpholine
Smiles: CC1(C)OCCC(C1)(CCN1CCOCC1)c1cccc(c1)C(F)(F)F

STK854427
Synonyms: 1-(4-chlorophenyl)-N-(2,6-dimethylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Clc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1c(C)cccc1C

STK854428
Synonyms: 6-(4-methylphenyl)-7-(thiophen-2-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Cc1ccc(cc1)C1Oc2ccccc2C2=C1C(c1cccs1)n1c(N2)ncn1

STK854430
Synonyms: N-(5-chloro-9-oxo-9H-xanthen-3-yl)-3-fluorobenzamide
Smiles: Fc1cccc(c1)C(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1Cl

STK854431
Synonyms: 1,7-di[(2E)-but-2-en-1-yl]-3,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: C/C=C/CN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)C/C=C/C

STK854432
Synonyms: (5E)-5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/c1cc(n(c1C)c1cccnc1)C)c1ccccc1C

STK854433
Synonyms: (5E)-5-(3,5-dichloro-4-hydroxybenzylidene)-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cc(Cl)c(c(c2)Cl)O)/C1=O)O

STK854434
Synonyms: (4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1noc(c1)C)/O

STK854438
Synonyms: 3,3'-[(3,4-dichlorophenyl)methanediyl]bis(4-hydroxy-1,6-dimethylpyridin-2(1H)-one)
Smiles: Oc1cc(C)n(c(=O)c1C(c1c(O)cc(n(c1=O)C)C)c1ccc(c(c1)Cl)Cl)C

STK854439
Synonyms: 1-[4-(3,4-dimethoxyphenyl)tetrahydro-2H-pyran-4-yl]-N-[(E)-(4-nitrophenyl)methylidene]methanamine
Smiles: COc1ccc(cc1OC)C1(CCOCC1)C/N=C/c1ccc(cc1)[N+](=O)[O-]

STK854440
Synonyms: 6-(4-chlorobenzyl)-3-[(3-chloro-2-methylphenyl)amino]-1,2,4-triazin-5-ol
Smiles: Clc1ccc(cc1)Cc1nnc(nc1O)Nc1cccc(c1C)Cl

STK854441
Synonyms: 6-chloro-7-hydroxy-4-methyl-3-[2-oxo-2-(piperidin-1-yl)ethyl]-2H-chromen-2-one
Smiles: O=C(N1CCCCC1)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl

STK854442
Synonyms: (5E)-3-(4-ethoxyphenyl)-6-hydroxy-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc(o2)c2ccccc2[N+](=O)[O-])/C1=O)O

STK854443
Synonyms: N-[(2Z)-4-(3-aminophenyl)-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: Nc1cccc(c1)c1cs/c(=N\C(=O)C)/[nH]1

STK854448
Synonyms: 2-[(5-bromo-1-methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)methyl]-3-(3-hydroxypropyl)quinazolin-4(3H)-one
Smiles: OCCCn1c(CC2c3cc(Br)ccc3N(C2=O)C)nc2c(c1=O)cccc2

STK854449
Synonyms: 3-(4-chlorophenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)n1c(SCC(=O)c2ccccc2)nc2c(c1=O)cccc2

STK854450
Synonyms: (4E)-4-[hydroxy(3-methoxyphenyl)methylidene]-5-(3-nitrophenyl)-1-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccccn1)/O

STK854451
Synonyms: (5E)-3-(3,4-dimethylphenyl)-6-hydroxy-5-[(5-nitrofuran-2-yl)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/c1ccc(o1)[N+](=O)[O-])c1ccc(c(c1)C)C

STK854452
Synonyms: N'-[(1E,2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]furan-2-carbohydrazide
Smiles: COc1ccccc1/C=C/C=N/NC(=O)c1ccco1

STK854454
Synonyms: (5E)-5-{[1-(4-fluorobenzyl)-1H-indol-3-yl]methylidene}-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cn(c3c2cccc3)Cc2ccc(cc2)F)/C1=O)O

STK854455
Synonyms: N-(5-fluoro-9-oxo-9H-xanthen-3-yl)-2-phenoxyacetamide
Smiles: O=C(Nc1ccc2c(c1)oc1c(c2=O)cccc1F)COc1ccccc1

STK854457
Synonyms: 4-(2-chlorobenzyl)-N-[(E)-(3,4-dichlorophenyl)methylidene]piperazin-1-amine
Smiles: Clc1cc(/C=N/N2CCN(CC2)Cc2ccccc2Cl)ccc1Cl

STK854458
Synonyms: 4-[4-(4-nitrophenyl)piperazin-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Smiles: [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)c1ncnc2c1cnn2c1ccccc1

STK854459
Synonyms: 2-hydroxy-3-{4-[4-(2-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}quinazolin-4(3H)-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)CCCn1c(O)nc2c(c1=O)cccc2

STK854463
Synonyms: N-(5-chloro-9-oxo-9H-xanthen-3-yl)-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1Cl

STK854467
Synonyms: 2-(2,5-dimethylphenyl)-5-(4-methoxyphenyl)-4-phenyl-1H-imidazole
Smiles: COc1ccc(cc1)c1[nH]c(nc1c1ccccc1)c1cc(C)ccc1C

STK854468
Synonyms: N-(3-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: COc1cccc(c1)Nc1ncnc2c1c1CCCc1s2

STK854471
Synonyms: 6-chloro-7-hydroxy-4-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-2H-chromen-2-one
Smiles: O=C(N1CCOCC1)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl

STK854472
Synonyms: 3-(4-chlorophenyl)-2-[(1-methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)methyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)n1c(CC2c3ccccc3N(C2=O)C)nc2c(c1=O)cccc2

STK854475
Synonyms: 2-(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: CCc1n[nH]/c(=N/C(=O)CN2C(=O)COc3c2cc(Cl)cc3)/s1

STK854476
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1Cc1cccnc1

STK854477
Synonyms: 2-{2-[3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl}-1,3-benzothiazole
Smiles: c1ccc2c(c1)sc(n2)CCc1nn2c(s1)nnc2c1cccs1

STK854479
Synonyms: 2,4-diacetyl-3-(4-fluorophenyl)-5-hydroxy-5-methylcyclohexanone
Smiles: Fc1ccc(cc1)C1C(C(=O)C)C(=O)CC(C1C(=O)C)(C)O

STK854480
Synonyms: [3-(1,3-benzothiazol-2-yl)pyrazin-2-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)c1nccnc1c1nc2c(s1)cccc2

STK854482
Synonyms: 3-(2-fluorobenzyl)-1,7,8-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Fc1ccccc1Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)C)C

STK854483
Synonyms: 1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(6-methyl-1H-benzimidazol-2-yl)propan-1-one
Smiles: Cc1ccc2c(c1)[nH]c(n2)CCC(=O)N1CCc2c(C1)cccc2

STK854485
Synonyms: (4E)-5-(4-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1nnc(s1)C

STK854488
Synonyms: 3-methyl-N-{1-methyl-2-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-1H-benzimidazol-5-yl}benzamide
Smiles: Cc1cccc(c1)C(=O)Nc1ccc2c(c1)nc(n2C)CCn1ccnc1C

STK854490
Synonyms: 2-[(4-hydroxy-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[3-(1H-imidazol-1-yl)propyl]acetamide
Smiles: O=C(CSc1nc(O)c2c(n1)sc(c2C)C)NCCCn1ccnc1

STK854491
Synonyms: 2-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1-(4-phenylpiperazin-1-yl)ethanone
Smiles: O=C(N1CCN(CC1)c1ccccc1)Cc1nn2c(n1)nc(c(c2C)Cl)C

STK854493
Synonyms: 8-(4-chlorophenyl)-1,7-dimethyl-3-(2-oxopropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccc(cc1)Cl)C

STK854496
Synonyms: 3-benzyl-8-(2-methoxyethyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)Cc1ccccc1

STK854499
Synonyms: 8-(4-ethylphenyl)-1,3-dimethyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)C

STK854500
Synonyms: (4E)-5-(2-fluorophenyl)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)c1nnc(s1)C)/O)C

STK854501
Synonyms: 2-(5-ethyl-1-benzofuran-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Smiles: CCc1ccc2c(c1)c(co2)CC(=O)Nc1noc(c1)C

STK854504
Synonyms: methyl2-[(3E)-3-[(4-fluorophenyl)(hydroxy)methylidene]-2-(3-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COc1cccc(c1)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC

STK854505
Synonyms: 2-(2-chlorophenyl)-5-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1cccs1)c1ccccc1Cl

STK854506
Synonyms: (4E)-5-(4-hydroxyphenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Oc1ccc(cc1)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854509
Synonyms: N-{3-[1-acetyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
Smiles: COc1ccc(cc1OC)C1CC(=NN1C(=O)C)c1cccc(c1)NS(=O)(=O)C

STK854511
Synonyms: 3-[(4-fluorophenyl)amino]-1,2,4-triazin-5-ol
Smiles: Fc1ccc(cc1)Nc1nncc(n1)O

STK854512
Synonyms: 4-[2-(4-nitrophenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])CN1C(=O)COc2c(C1=O)cccc2

STK854513
Synonyms: 3-(2-methoxyethyl)-1-methyl-9-(2-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccccc1C

STK854515
Synonyms: (4E)-5-(2-fluorophenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccccc1F)Cc1cccnc1)/c1cccs1

STK854517
Synonyms: 1-(4-bromophenyl)-5-[(2-methylphenoxy)methyl]-1H-tetrazole
Smiles: Brc1ccc(cc1)n1nnnc1COc1ccccc1C

STK854520
Synonyms: 3,4,5-trimethoxy-N-(9-oxo-9H-xanthen-3-yl)benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1

STK854521
Synonyms: 5-ethyl-6-(thiophen-3-yl)-5,6-dihydrobenzimidazo[1,2-c]quinazoline
Smiles: CCN1c2ccccc2c2n(C1c1cscc1)c1ccccc1n2

STK854523
Synonyms: 2-{[3-cyano-6-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl}-N-(4-fluorobenzyl)acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)NCc1ccc(cc1)F)c1ccc(c(c1)OC)OC

STK854524
Synonyms: 3-(4-bromobenzyl)-8-(2-hydroxyethyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)Br

STK854530
Synonyms: 2-chloro-7-(4-methoxyphenyl)-6-(thiophen-2-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1)C1C2=C(Nc3n1ncn3)c1c(OC2c2cccs2)ccc(c1)Cl

STK854532
Synonyms: 4-(acetylamino)-N-{(1E)-3-[(2-hydroxyethyl)amino]-3-oxo-1-phenylprop-1-en-2-yl}benzamide
Smiles: OCCNC(=O)/C(=C\c1ccccc1)/NC(=O)c1ccc(cc1)NC(=O)C

STK854533
Synonyms: N'-[(1Z)-1-(pyridin-3-yl)ethylidene]pyridine-2-carbohydrazide
Smiles: C/C(=N/NC(=O)c1ccccn1)/c1cccnc1

STK854535
Synonyms: N-(5-fluoro-9-oxo-9H-xanthen-3-yl)-2-nitrobenzamide
Smiles: O=C(c1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)oc1c(c2=O)cccc1F

STK854536
Synonyms: ethyl3-{3-[2-(4-methoxyphenyl)ethyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-7-yl}propanoate
Smiles: CCOC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)OCN(C1)CCc1ccc(cc1)OC

STK854538
Synonyms: (5E)-5-(4-bromobenzylidene)-6-hydroxy-3-phenylpyrimidine-2,4(3H,5H)-dione
Smiles: Brc1ccc(cc1)/C=C/1\C(=NC(=O)N(C1=O)c1ccccc1)O

STK854541
Synonyms: 1-[(2Z)-5-[(4-tert-butylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(2-methoxyphenyl)urea
Smiles: COc1ccccc1NC(=O)/N=c\1/[nH]nc(s1)COc1ccc(cc1)C(C)(C)C

STK854543
Synonyms: (2Z)-4-methyl-3-oxo-7-(piperidinium-1-ylmethyl)-2-(2,3,4-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1c(ccc(c1OC)OC)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCCCC1)[O-]

STK854547
Synonyms: N-{4-[1-(ethylsulfonyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
Smiles: CCS(=O)(=O)N1N=C(CC1c1ccco1)c1ccc(cc1)NS(=O)(=O)C

STK854553
Synonyms: (4E)-5-(2,3-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-[3-(1H-imidazol-1-yl)propyl]pyrrolidine-2,3-dione
Smiles: COc1c(OC)cccc1C1N(CCCn2cncc2)C(=O)C(=O)/C/1=C(\c1ccccc1)/O

STK854554
Synonyms: (2Z)-2-(3,4-dimethoxybenzylidene)-4-methyl-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1cc(ccc1OC)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCN(CC1)C)[O-]

STK854558
Synonyms: N-[(2Z)-3-(4-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: COc1ccc(cc1)N1/C(=N/C(=O)C)/SC2C1CS(=O)(=O)C2

STK854559
Synonyms: 3-hydroxy-1-(2-hydroxyethyl)-5-phenyl-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: OCCN1C(=O)C(=C(C1c1ccccc1)C(=O)/C=C/c1ccccc1)O

STK854560
Synonyms: 5-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methoxyphenol
Smiles: COc1ccc(cc1O)c1[nH]c(c(n1)c1ccccc1)c1ccc(cc1)Br

STK854562
Synonyms: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-5-(furan-2-yl)-4-[hydroxy(5-methylfuran-2-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccco2)/C(=C(/c2ccc(o2)C)\O)/C(=O)C1=O

STK854564
Synonyms: 6-methoxy-2-[2-(morpholin-4-yl)ethyl]-1-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)CCN1CCOCC1)c1ccccn1

STK854566
Synonyms: (4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-5-(4-methoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)OC)c1noc(c1)C)/O

STK854567
Synonyms: (4E)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854568
Synonyms: 3-(2-oxo-1,3-benzothiazol-3(2H)-yl)-N-[(2E)-4-phenyl-1,3-thiazol-2(3H)-ylidene]propanamide
Smiles: O=C(/N=c\1/scc([nH]1)c1ccccc1)CCn1c(=O)sc2c1cccc2

STK854569
Synonyms: (4E)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-1-(2-methoxyethyl)-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(o2)C)/O)/C1c1cccc(c1)OC

STK854571
Synonyms: (5Z)-5-{[5-(4-chloro-3-nitrophenyl)furan-2-yl]methylidene}-3-(2-fluorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/c2ccc(o2)c2ccc(c(c2)[N+](=O)[O-])Cl)/C(=O)N1c1ccccc1F

STK854574
Synonyms: (5E)-5-({5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-6-hydroxy-2-sulfanylpyrimidin-4(5H)-one
Smiles: SC1=NC(=O)/C(=C/c2ccc(o2)Sc2ccc(cc2)Cl)/C(=N1)O

STK854575
Synonyms: 4-(2-chlorobenzyl)-N-[(1E,2E)-2-chloro-3-phenylprop-2-en-1-ylidene]piperazin-1-amine
Smiles: Cl/C(=C/c1ccccc1)/C=N/N1CCN(CC1)Cc1ccccc1Cl

STK854584
Synonyms: 2-(1,3-benzothiazol-2-yl)-N-cyclohexylpyridine-3-carboxamide
Smiles: O=C(c1cccnc1c1nc2c(s1)cccc2)NC1CCCCC1

STK854586
Synonyms: 2-nitro-N-(9-oxo-9H-xanthen-3-yl)benzamide
Smiles: O=C(c1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)oc1c(c2=O)cccc1

STK854587
Synonyms: 2-{[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl}-7,8-dimethyl-4H-chromen-4-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)c1cc(=O)c2c(o1)c(C)c(cc2)C

STK854588
Synonyms: 1-methyl-8-phenyl-3-(prop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: C=CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1

STK854590
Synonyms: 3-benzyl-1,6,7-trimethyl[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: Cc1oc2n(c1C)c1c(n2)n(C)c(=O)n(c1=O)Cc1ccccc1

STK854591
Synonyms: (4E)-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1O)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1Cc1cccnc1

STK854592
Synonyms: ethyl4-[(4-bromophenyl)amino]-2-methyl-5-oxo-1-phenyl-2,5-dihydro-1H-pyrrole-2-carboxylate
Smiles: CCOC(=O)C1(C)C=C(C(=O)N1c1ccccc1)Nc1ccc(cc1)Br

STK854594
Synonyms: 6-bromo-3-(2-methylphenyl)-2-[(E)-2-(2-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Brc1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1C

STK854595
Synonyms: 2-methyl-4-[2-(4-nitrophenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CC1Oc2ccccc2C(=O)N(C1=O)CC(=O)c1ccc(cc1)[N+](=O)[O-]

STK854598
Synonyms: 4-[2-(2-ethoxy-5-fluorophenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCOc1ccc(cc1C(=O)CN1C(=O)COc2c(C1=O)cccc2)F

STK854601
Synonyms: 7-fluoro-1-(pyridin-2-yl)-2-(1,3-thiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccn1)c1nccs1

STK854602
Synonyms: 4-{2-[3-fluoro-4-(propan-2-yloxy)phenyl]-2-oxoethyl}-2-methyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CC(Oc1ccc(cc1F)C(=O)CN1C(=O)C(C)Oc2c(C1=O)cccc2)C

STK854603
Synonyms: 4-(1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl)benzenesulfonamide
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc1n2cc(n1c1ccc(cc1)S(=O)(=O)N)C

STK854605
Synonyms: methyl2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)C(=O)NCc2ccco2)sc2c1CCC2

STK854606
Synonyms: N-[(2Z)-5-(4-ethoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-methoxybenzamide
Smiles: CCOc1ccc(cc1)c1n[nH]/c(=N/C(=O)c2ccc(cc2)OC)/s1

STK854608
Synonyms: 2-ethoxy-3-[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]-6-(4-methylphenyl)pyridine
Smiles: CCOc1nc(ccc1c1noc(n1)c1ccco1)c1ccc(cc1)C

STK854609
Synonyms: methyl4-({[1-(4-chlorophenyl)-4-oxo-1,4-dihydropyridazin-3-yl]carbonyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)c1nn(ccc1=O)c1ccc(cc1)Cl

STK854610
Synonyms: 8-(2-hydroxyethyl)-1,6,7-trimethyl-3-(2-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCn1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCc1ccccc1

STK854611
Synonyms: 1,3,7,9-tetramethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC1=NN(C)c2n(C1)c1c(=O)n(C)c(=O)n(c1n2)C

STK854612
Synonyms: N-(6-methoxy-1,3-benzothiazol-2-yl)-5,7-dimethyl-4-oxo-4H-chromene-2-carboxamide
Smiles: COc1ccc2c(c1)sc(n2)NC(=O)c1cc(=O)c2c(o1)cc(cc2C)C

STK854613
Synonyms: 3-benzyl-8-(furan-2-ylmethyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Cn1c(=O)n(Cc2ccccc2)c(=O)c2c1nc1n2CCN1Cc1ccco1

STK854615
Synonyms: 2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-methyl-1,3-thiazole
Smiles: Fc1ccc(cc1)C1CC(=NN1c1scc(n1)C)c1cccs1

STK854620
Synonyms: 1-(4-chlorophenyl)-N-(2,5-dimethylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Clc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1cc(C)ccc1C

STK854622
Synonyms: (5E)-3-(1,3-benzodioxol-5-yl)-6-hydroxy-5-{4-[(3-nitrobenzyl)oxy]benzylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/c1ccc(cc1)OCc1cccc(c1)[N+](=O)[O-])c1ccc2c(c1)OCO2

STK854624
Synonyms: 1-(2,1,3-benzoxadiazol-4-ylsulfonyl)-N-(3-chlorophenyl)piperidine-4-carboxamide
Smiles: Clc1cccc(c1)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1non2

STK854625
Synonyms: N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-(3,4-dimethylphenoxy)propanamide
Smiles: COc1cc(ccc1OC)c1nonc1NC(=O)C(Oc1ccc(c(c1)C)C)C

STK854626
Synonyms: (4E)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(2-methoxyethyl)-5-(3-phenoxyphenyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1cccc(c1)Oc1ccccc1

STK854629
Synonyms: (5E)-6-hydroxy-5-[(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)methylidene]-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C\C2C(=NN(C2=O)c2ccccc2)C)/C1=O)O

STK854630
Synonyms: ethyl[(4-hydroxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nc(O)c2c(n1)sc1c2CCCC1

STK854635
Synonyms: 1,3,6,7-tetramethyl-8-(1-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(n1c(C)c(n2c1nc1c2c(=O)n(c(=O)n1C)C)C)c1ccccc1

STK854637
Synonyms: (2Z)-4-methyl-7-[(4-methylpiperidinium-1-yl)methyl]-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: CC1CC[NH+](CC1)Cc1c([O-])cc(c2c1O/C(=C\c1ccncc1)/C2=O)C

STK854638
Synonyms: 2-amino-N-(2-methoxyethyl)-1-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)C(C)C

STK854645
Synonyms: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N'-(pyridin-2-ylmethyl)ethanediamide
Smiles: O=C(C(=O)NCc1ccccn1)Nc1sc2c(c1C(=O)N)CCCC2

STK854648
Synonyms: (4E)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(pyridin-3-ylmethyl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1Cc1cccnc1

STK854651
Synonyms: N-[3-(5-phenyl-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl)phenyl]methanesulfonamide
Smiles: CCC(=O)N1N=C(CC1c1ccccc1)c1cccc(c1)NS(=O)(=O)C

STK854652
Synonyms: 1-(2-chloro-6-fluorobenzyl)-3,7,9-trimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC1=NN(Cc2c(F)cccc2Cl)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)C

STK854654
Synonyms: (5E)-5-({2,5-dimethyl-1-[4-(morpholin-4-yl)phenyl]-1H-pyrrol-3-yl}methylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)N2CCOCC2)C)/C(=N1)O

STK854655
Synonyms: (4E)-5-(3-chlorophenyl)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)c1ccccn1)/O)C

STK854656
Synonyms: (5E)-3-(4-chlorophenyl)-6-hydroxy-5-[(1,2,5-trimethyl-1H-pyrrol-3-yl)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cc(n(c2C)C)C)/C1=O)O

STK854658
Synonyms: (5E)-6-hydroxy-5-{[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylidene}-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc(o2)c2ccc(cc2OC)[N+](=O)[O-])/C1=O)O

STK854662
Synonyms: (4E)-4-[hydroxy(3-methoxyphenyl)methylidene]-5-(3-methoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)OC)c1noc(c1)C)/O

STK854663
Synonyms: propan-2-yl4-(3,4-dimethoxyphenyl)-2-methyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: COc1cc(ccc1OC)C1C(=C(C)N=c2n1c1ccccc1[nH]2)C(=O)OC(C)C

STK854664
Synonyms: (2Z)-2-[4-(methoxycarbonyl)benzylidene]-4-methyl-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCCC1)[O-]

STK854665
Synonyms: N-[(1E)-1-(3,4-dichlorophenyl)ethylidene]-4-(2-methoxyphenyl)piperazin-1-amine
Smiles: COc1ccccc1N1CCN(CC1)/N=C(/c1ccc(c(c1)Cl)Cl)\C

STK854666
Synonyms: (2Z)-4-methyl-7-[(4-methylpiperidinium-1-yl)methyl]-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: CC1CC[NH+](CC1)Cc1c([O-])cc(c2c1O/C(=C\c1cccnc1)/C2=O)C

STK854667
Synonyms: 2-{[benzyl(2-hydroxyethyl)carbamoyl]amino}-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxamide
Smiles: OCCN(C(=O)Nc1sc2c(c1C(=O)N)CC(OC2)(C)C)Cc1ccccc1

STK854669
Synonyms: N-(2-chlorobenzyl)-2,3-dimethyl-1H-indole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)NCc1ccccc1Cl

STK854670
Synonyms: 6-chloro-9-(2-methoxybenzyl)-4-propyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c1c2CN(CO1)Cc1ccccc1OC

STK854671
Synonyms: N-[(2Z)-5-chloro-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]-5-nitrofuran-2-carboxamide
Smiles: COc1cc2s/c(=N\C(=O)c3ccc(o3)[N+](=O)[O-])/[nH]c2cc1Cl

STK854674
Synonyms: 6-bromo-3-(3-methylphenyl)-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Brc1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)[N+](=O)[O-])c1cccc(c1)C

STK854675
Synonyms: 1-(2,1,3-benzoxadiazol-4-ylsulfonyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide
Smiles: COc1cccc(c1)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1non2

STK854678
Synonyms: 4-[2-(3-nitrophenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CN1C(=O)COc2c(C1=O)cccc2

STK854681
Synonyms: 4-hydroxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]-1,3-diazaspiro[5.5]undeca-1,3-diene-5-carbonitrile
Smiles: N#CC1C(=NC(=NC21CCCCC2)N1CCN(CC1)c1cccc(c1)OC)O

STK854682
Synonyms: N-[6-(pyrrolidin-1-ylsulfonyl)-1,3-benzothiazol-2-yl]pyridine-4-carboxamide
Smiles: O=C(c1ccncc1)Nc1nc2c(s1)cc(cc2)S(=O)(=O)N1CCCC1

STK854683
Synonyms: 4-[2-(3-fluoro-4-methoxyphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: COc1ccc(cc1F)C(=O)CN1C(=O)COc2c(C1=O)cccc2

STK854684
Synonyms: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-N'-(tetrahydrofuran-2-ylmethyl)ethanediamide
Smiles: O=C(C(=O)Nc1sc2c(c1C(=O)N)CC(OC2)(C)C)NCC1CCCO1

STK854685
Synonyms: {[9-methyl-4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}propanedinitrile
Smiles: N#CC(=Cc1c(nc2n(c1=O)cccc2C)N1CCCCC1)C#N

STK854686
Synonyms: (2Z)-4-methyl-3-oxo-7-(piperidinium-1-ylmethyl)-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)c(C)cc(c3C[NH+]2CCCCC2)[O-])cc(c1OC)OC

STK854687
Synonyms: 1-(4-bromobenzyl)-3,7,9-trimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: Brc1ccc(cc1)CN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)C

STK854688
Synonyms: 2-({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)-1,2-benzothiazol-3(2H)-one1,1-dioxide
Smiles: O=C1c2ccccc2S(=O)(=O)N1Cc1nnnn1c1cccc(c1)C(F)(F)F

STK854690
Synonyms: 7-(4-methylphenyl)-6-(thiophen-2-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Cc1ccc(cc1)C1n2ncnc2NC2=C1C(Oc1c2cccc1)c1cccs1

STK854692
Synonyms: methyl2-{[(benzylamino)(oxo)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)C(=O)NCc2ccccc2)sc2c1CCC2

STK854694
Synonyms: 1,6,7,8-tetramethyl-3-(2-oxopropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=O)Cn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)C

STK854695
Synonyms: 4-[2-(2-ethoxyphenyl)-2-oxoethyl]-2-propyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCCC1Oc2ccccc2C(=O)N(C1=O)CC(=O)c1ccccc1OCC

STK854696
Synonyms: (5Z)-6-hydroxy-5-[2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-ylidene]-3-methylpyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)C1C/C(=C/2\C(=NC(=O)N(C2=O)C)O)/Nc2c(S1)cccc2

STK854698
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)cccc2

STK854700
Synonyms: 1-(2,5-dichlorothiophen-3-yl)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]ethanone
Smiles: Clc1sc(c(c1)C(=O)CSc1ncnc2c1c(C)c(s2)C)Cl

STK854702
Synonyms: 1,6,7-trimethyl-3-(2-methylpropyl)[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1c(n2)oc(c1C)C)C

STK854703
Synonyms: 5-chloro-3-(2-methoxybenzyl)-1,3-benzoxazol-2(3H)-one
Smiles: COc1ccccc1Cn1c(=O)oc2c1cc(Cl)cc2

STK854704
Synonyms: 3-{[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-sulfamoylphenyl)propanamide
Smiles: C=CCn1c(SCCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nc2c(c1=O)c1CCCCc1s2

STK854706
Synonyms: ethyl{[6-bromo-3-(4-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)C)Br

STK854708
Synonyms: ethyl[4-hydroxy-6-methyl-2-(propylsulfanyl)pyrimidin-5-yl]acetate
Smiles: CCCSc1nc(C)c(c(n1)O)CC(=O)OCC

STK854709
Synonyms: N-[4-(azepan-1-ylsulfonyl)phenyl]-1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: O=C(c1nn(ccc1=O)c1ccc(cc1)F)Nc1ccc(cc1)S(=O)(=O)N1CCCCCC1

STK854710
Synonyms: 1,7-dimethyl-3-(2-phenylethyl)[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: Cc1oc2n(c1)c1c(n2)n(C)c(=O)n(c1=O)CCc1ccccc1

STK854711
Synonyms: 1-(3-fluorophenyl)-6-methoxy-2-(1,3-thiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)c1nccs1)c1cccc(c1)F

STK854713
Synonyms: 3-nitro-N-(9-oxo-9H-xanthen-3-yl)benzamide
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Nc1ccc2c(c1)oc1c(c2=O)cccc1

STK854714
Synonyms: 7-benzyl-3,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC1=NNc2n(C1)c1c(=O)n(Cc3ccccc3)c(=O)n(c1n2)C

STK854717
Synonyms: (3Z,5E)-1-methyl-3,5-bis(2,3,4-trimethoxybenzylidene)piperidin-4-one
Smiles: COc1c(ccc(c1OC)OC)/C=C/1\CN(C)C/C(=C/c2ccc(c(c2OC)OC)OC)/C1=O

STK854718
Synonyms: (4E)-5-(4-bromophenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: Brc1ccc(cc1)C1/C(=C(/c2ccco2)\O)/C(=O)C(=O)N1Cc1cccnc1

STK854719
Synonyms: 4-[2-(4-chlorophenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: Clc1ccc(cc1)C(=O)CN1C(=O)COc2c(C1=O)cccc2

STK854720
Synonyms: N'-[(E)-(4-bromophenyl)methylidene]-2-(thiophen-2-yl)acetohydrazide
Smiles: O=C(Cc1cccs1)N/N=C/c1ccc(cc1)Br

STK854723
Synonyms: N-[4-(acetylamino)phenyl]-1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: CC(=O)Nc1ccc(cc1)NC(=O)c1nn(ccc1=O)c1ccc(cc1)F

STK854724
Synonyms: 6-amino-4-cyclohexyl-3-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1C1CCCCC1)c(CSc1ccc(cc1)C)[nH]n2

STK854726
Synonyms: ethyl2-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)C)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STK854727
Synonyms: 1,7-dimethyl-3-(2-methylprop-2-en-1-yl)-8-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)CCN1CCOCC1)C

STK854728
Synonyms: (5E)-3-(4-chlorophenyl)-5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cc(n(c2C)c2cccnc2)C)/C1=O)O

STK854732
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854733
Synonyms: 1-{3-[(6-chloro-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]phenyl}ethanone
Smiles: CC(=O)c1cccc(c1)Nc1c(Cl)c(C)nc2n1ncn2

STK854735
Synonyms: 3-(2-hydroxy-3-methylphenyl)-3-phenyl-N-[(1-phenylcyclopentyl)methyl]propanamide
Smiles: O=C(CC(c1cccc(c1O)C)c1ccccc1)NCC1(CCCC1)c1ccccc1

STK854736
Synonyms: N-[2-(cyclohex-1-en-1-yl)ethyl]-2,3-dimethyl-1H-indole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)NCCC1=CCCCC1

STK854737
Synonyms: 6-bromo-2-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]-3-phenylquinazolin-4(3H)-one
Smiles: COc1cc(ccc1O)/C=C/c1nc2ccc(cc2c(=O)n1c1ccccc1)Br

STK854738
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(pyridin-3-ylmethyl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1Cc1cccnc1

STK854739
Synonyms: methyl4-{3-[(Z)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]-2,5-diphenyl-1H-pyrrol-1-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)n1c(cc(c1c1ccccc1)/C=C\1/C(=NC(=NC1=O)S)O)c1ccccc1

STK854740
Synonyms: (2E)-3-(3,4-dimethoxyphenyl)-N-[(2E)-4-(4-fluorophenyl)-1,3-thiazol-2(3H)-ylidene]prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)/N=c\2/scc([nH]2)c2ccc(cc2)F)ccc1OC

STK854741
Synonyms: N-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-N'-(3-methylbutyl)ethanediamide
Smiles: CC(CCNC(=O)C(=O)Nc1sc2c(c1C(=O)N)CCC2)C

STK854743
Synonyms: N-{3-[1-(2-methylpropanoyl)-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
Smiles: O=C(N1N=C(CC1c1ccccc1)c1cccc(c1)NS(=O)(=O)C)C(C)C

STK854744
Synonyms: N-(furan-2-ylmethyl)-3-(4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: O=C(CCn1cnc2c(c1=O)cccc2)NCc1ccco1

STK854749
Synonyms: (5E)-5-(3,5-dichloro-4-hydroxybenzylidene)-6-hydroxy-3-[4-(propan-2-yl)phenyl]pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\c2cc(Cl)c(c(c2)Cl)O)/C(=O)N1c1ccc(cc1)C(C)C

STK854750
Synonyms: N-[4-({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methoxy)phenyl]benzamide
Smiles: O=C(c1ccccc1)Nc1ccc(cc1)OCc1nnnn1c1cccc(c1)C(F)(F)F

STK854751
Synonyms: N-benzyl-2-[(5Z)-5-{[(2-methylphenyl)carbamoyl]imino}-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide
Smiles: O=C(Cc1n[nH]/c(=N/C(=O)Nc2ccccc2C)/s1)NCc1ccccc1

STK854753
Synonyms: 5-(3,4-dimethoxyphenyl)-2-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: COc1cc(ccc1OC)c1cc(O)n2c(n1)nc(n2)C(F)(F)F

STK854754
Synonyms: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N'-(pyridin-3-ylmethyl)ethanediamide
Smiles: N#Cc1c(NC(=O)C(=O)NCc2cccnc2)sc2c1CCCC2

STK854757
Synonyms: 2-[1,6,7-trimethyl-8-(2-methylpropyl)-2,4-dioxo-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]acetamide
Smiles: CC(Cn1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CC(=O)N)C

STK854759
Synonyms: 3-(3-hydroxypropyl)-1,7-dimethyl[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1cc(oc1n2)C

STK854761
Synonyms: N-[(2Z)-5-(ethylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: CCSc1n[nH]/c(=N/C(=O)c2nn(ccc2=O)c2ccc(cc2)F)/s1

STK854762
Synonyms: 4-acetyl-1-hexyl-3-hydroxy-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCCCN1C(c2ccc(cc2)C(C)C)C(=C(C1=O)O)C(=O)C

STK854763
Synonyms: 8-(2-methoxyethyl)-1,7-dimethyl-3-[(2E)-3-phenylprop-2-en-1-yl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)C/C=C/c1ccccc1

STK854765
Synonyms: 6-chloro-4-[2-(3-hydroxyquinoxalin-1(2H)-yl)-2-oxoethyl]-2H-1,4-benzoxazin-3(4H)-one
Smiles: OC1=Nc2ccccc2N(C1)C(=O)CN1C(=O)COc2c1cc(Cl)cc2

STK854766
Synonyms: propan-2-yl4-[4-(dimethylamino)phenyl]-2-methyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: CC(OC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c1ccccc1[nH]2)C

STK854768
Synonyms: 1-methyl-3-(2-methylprop-2-en-1-yl)-7-phenyl[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1cc(oc1n2)c1ccccc1

STK854769
Synonyms: 5-chloro-2-(methylsulfanyl)-N-(quinolin-5-yl)pyrimidine-4-carboxamide
Smiles: CSc1ncc(c(n1)C(=O)Nc1cccc2c1cccn2)Cl

STK854772
Synonyms: 2-{2-[4-(2-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1CCN(CC1)c1ccccc1Cl)CN1C(=O)c2c(C1=O)cccc2

STK854774
Synonyms: (2Z)-2-(2-methoxybenzylidene)-4-methyl-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1ccccc1/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCN(CC1)C)[O-]

STK854776
Synonyms: 2-{3-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Smiles: COc1cc(ccc1OCCOc1ccccc1OC)c1nc(O)c2c(n1)sc1c2CCCC1

STK854780
Synonyms: 2-[(1,5-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-yl)methyl]-3-(3-hydroxypropyl)quinazolin-4(3H)-one
Smiles: OCCCn1c(CC2c3cc(C)ccc3N(C2=O)C)nc2c(c1=O)cccc2

STK854782
Synonyms: 4-[4-(4-fluorophenoxy)-3-methyl-1H-pyrazol-5-yl]-2-methylbenzene-1,3-diol
Smiles: Fc1ccc(cc1)Oc1c(C)n[nH]c1c1ccc(c(c1O)C)O

STK854783
Synonyms: methyl1-(2-chlorophenyl)-5-(2-methoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccccc1OC)c1ccccc1Cl

STK854784
Synonyms: 2-[(4-tert-butylphenoxy)methyl]-1-methyl-1H-benzimidazole
Smiles: Cn1c(COc2ccc(cc2)C(C)(C)C)nc2c1cccc2

STK854785
Synonyms: 9-(2,4-dimethoxyphenyl)-1-methyl-3-propyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1OC)OC

STK854788
Synonyms: 3-(2-fluorobenzyl)-8-(4-methoxybenzyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1F

STK854789
Synonyms: (2Z)-7-[(dimethylammonio)methyl]-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: C[NH+](Cc1c([O-])cc(c2c1O/C(=C\c1cccnc1)/C2=O)C)C

STK854791
Synonyms: 8-(2-hydroxyphenyl)-1,7-dimethyl-3-[(2E)-3-phenylprop-2-en-1-yl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Oc1ccccc1n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)C/C=C/c1ccccc1

STK854793
Synonyms: (5E)-3-(2,5-dimethoxyphenyl)-6-hydroxy-5-(2,4,5-trimethoxybenzylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(c(c1)N1C(=O)N=C(/C(=C\c2cc(OC)c(cc2OC)OC)/C1=O)O)OC

STK854796
Synonyms: 2-(4-fluorophenyl)-5-{4-[(4-fluorophenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccc(cc1)F)c1ccc(cc1)F

STK854797
Synonyms: (5E)-3-(3,5-dimethylphenyl)-6-hydroxy-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1cc(C)cc(c1)N1C(=O)N=C(/C(=C\c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/C1=O)O

STK854798
Synonyms: 3-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-2-hydroxyquinazolin-4(3H)-one
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)CCn1c(O)nc2c(c1=O)cccc2

STK854799
Synonyms: methyl4-[(3E)-3-[hydroxy(3-methoxyphenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-4,5-dioxopyrrolidin-2-yl]benzoate
Smiles: COc1cccc(c1)/C(=C\1/C(c2ccc(cc2)C(=O)OC)N(C(=O)C1=O)c1noc(c1)C)/O

STK854800
Synonyms: (5E)-5-({1-[4-(dimethylamino)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}methylidene)-3-(4-fluorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cc(n(c2C)c2ccc(cc2)N(C)C)C)/C1=O)O

STK854802
Synonyms: N-(4-{[1,4-dioxo-3-(pyrrolidin-1-yl)-1,4-dihydronaphthalen-2-yl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)NC1=C(N2CCCC2)C(=O)c2c(C1=O)cccc2

STK854803
Synonyms: (5E)-3-(3,4-dimethylphenyl)-6-hydroxy-5-(2,3,4-trimethoxybenzylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1c(ccc(c1OC)OC)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)O

STK854804
Synonyms: N-(3-chloro-4-{4-[(1-methyl-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(c(c1)Cl)N1CCN(CC1)Cc1nc2c(n1C)cccc2

STK854806
Synonyms: (5E)-5-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)Br)C)/C(=N1)O

STK854807
Synonyms: 3-(1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide
Smiles: O=C(c1nccnc1c1nc2c(s1)cccc2)NCc1cccnc1

STK854809
Synonyms: (5Z)-3-[2-(cyclohex-1-en-1-yl)ethyl]-6-hydroxy-5-(thiophen-2-ylmethylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/c2cccs2)/C(=O)N1CCC1=CCCCC1

STK854810
Synonyms: 2-(2-chlorophenyl)-5-{4-[(2-fluorophenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccccc1F)c1ccccc1Cl

STK854811
Synonyms: 2-(2-bromo-6-methyl-1-benzofuran-3-yl)acetamide
Smiles: NC(=O)Cc1c(Br)oc2c1ccc(c2)C

STK854812
Synonyms: 2-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-(4-fluorophenyl)acetamide
Smiles: O=C(Cc1nn2c(n1)nc(cc2C)C)Nc1ccc(cc1)F

STK854813
Synonyms: (2Z)-2-(furan-2-ylmethylidene)-4-methyl-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: Cc1cc([O-])c(c2c1C(=O)/C(=C/c1ccco1)/O2)C[NH+]1CCCC1

STK854814
Synonyms: 2-(2-methoxyphenyl)-5-{4-[(3-methoxyphenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: COc1cccc(c1)C(=O)N1CCN(CC1)c1oc(nc1C#N)c1ccccc1OC

STK854816
Synonyms: 7-chloro-1-(pyridin-2-yl)-2-(1,3-thiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccn1)c1nccs1

STK854817
Synonyms: (5E)-1-(3-bromophenyl)-5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Brc1cccc(c1)N1C(=NC(=O)/C(=C\c2cc(n(c2C)c2cccnc2)C)/C1=O)S

STK854821
Synonyms: (5E)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cc(n(c2C)c2ccc(cc2)F)C)/C1=O)O

STK854823
Synonyms: 7,8-dimethoxy-4-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-2H-chromen-2-one
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)N1CCOCC1

STK854824
Synonyms: (2E)-2-(1,3-benzothiazol-2-yl)-3-(4-ethoxy-3-methoxyphenyl)prop-2-enenitrile
Smiles: CCOc1ccc(cc1OC)/C=C(/c1nc2c(s1)cccc2)\C#N

STK854825
Synonyms: N-(5-chloro-2-methoxyphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(Cl)ccc2OC)nc2c(c1=O)c1CCCc1s2

STK854826
Synonyms: 1-(2,4-dimethylphenyl)-N-(3,5-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Smiles: Cc1ccc(c(c1)C)n1ncc2c1ncnc2Nc1cc(C)cc(c1)C

STK854828
Synonyms: 1-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea
Smiles: O=C(Nc1ccccc1)Nc1ccc2c(c1)nc(n2C)CCn1nc(cc1C)C

STK854830
Synonyms: 1-(4-chlorophenyl)-N-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Clc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1cccc(c1)C

STK854832
Synonyms: 2-chloro-N-(5-fluoro-9-oxo-9H-xanthen-3-yl)benzamide
Smiles: O=C(c1ccccc1Cl)Nc1ccc2c(c1)oc1c(c2=O)cccc1F

STK854833
Synonyms: propan-2-yl4-(4-hydroxyphenyl)-2-methyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: CC(OC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)O)c1ccccc1[nH]2)C

STK854834
Synonyms: 3-{(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-(thiomorpholin-4-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: COCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCSCC2)/C1=O

STK854836
Synonyms: 3-phenyl-2-sulfanyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: Sc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCC3

STK854837
Synonyms: 7-(2-ethoxyphenyl)-5-methyl-N-(2-methylphenyl)-3,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: CCOc1ccccc1C1C(=C(C)N=c2n1nn[nH]2)C(=O)Nc1ccccc1C

STK854839
Synonyms: 1,7-dimethyl-3-(2-oxopropyl)-8-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccccc1)C

STK854840
Synonyms: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[2-(4-chlorophenyl)ethyl]piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2)NCCc1ccc(cc1)Cl

STK854841
Synonyms: 3-(3-chlorophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Smiles: Clc1cccc(c1)N1CN=C2N(C1)C(=O)CS2

STK854842
Synonyms: (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-5-(3-methoxyphenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)C1N(c2nnc(s2)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/O

STK854843
Synonyms: 8-(azepan-1-yl)-7-[(2E)-3-chlorobut-2-en-1-yl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C(=C\Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCCCCC1)/Cl

STK854845
Synonyms: (4E)-4-[hydroxy(4-methylphenyl)methylidene]-5-(3-methoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854846
Synonyms: 4-[2-(3-methoxyphenyl)-2-oxoethyl]-2-phenyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: COc1cccc(c1)C(=O)CN1C(=O)C(Oc2c(C1=O)cccc2)c1ccccc1

STK854847
Synonyms: (4E)-5-(3-bromophenyl)-4-[hydroxy(4-methylphenyl)methylidene]-1-(pyrimidin-2-yl)pyrrolidine-2,3-dione
Smiles: Brc1cccc(c1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1ncccn1

STK854848
Synonyms: N-{1-methyl-2-[2-(2-oxopyridin-1(2H)-yl)ethyl]-1H-benzimidazol-5-yl}acetamide
Smiles: CC(=O)Nc1ccc2c(c1)nc(n2C)CCn1ccccc1=O

STK854850
Synonyms: ethyl[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]acetate
Smiles: CCOC(=O)COc1ccc2c(c1)c(C)cc(=O)o2

STK854853
Synonyms: 4-[4-phenyl-5-(thiophen-2-yl)-1H-imidazol-2-yl]phenol
Smiles: Oc1ccc(cc1)c1[nH]c(c(n1)c1ccccc1)c1cccs1

STK854854
Synonyms: 2-methoxyethyl4-(3-methoxyphenyl)-2-methyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: COCCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1)OC)c1ccccc1[nH]2

STK854855
Synonyms: N-[4-({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methoxy)phenyl]propanamide
Smiles: CCC(=O)Nc1ccc(cc1)OCc1nnnn1c1cccc(c1)C(F)(F)F

STK854856
Synonyms: 2-[4-(methylsulfanyl)phenyl]-4-phenyl-5-(thiophen-2-yl)-1H-imidazole
Smiles: CSc1ccc(cc1)c1[nH]c(c(n1)c1ccccc1)c1cccs1

STK854858
Synonyms: 2-(3,4-dichlorobenzyl)-5-(4-fluorophenyl)-2H-tetrazole
Smiles: Fc1ccc(cc1)c1nnn(n1)Cc1ccc(c(c1)Cl)Cl

STK854860
Synonyms: 1-(2,6-dichlorobenzyl)-3,7,9-trimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC1=NN(Cc2c(Cl)cccc2Cl)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)C

STK854861
Synonyms: N-(5-chloro-9-oxo-9H-xanthen-3-yl)-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1Cl

STK854863
Synonyms: ethyl4-{[3-(ethoxycarbonyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)Nc1sc2c(c1C(=O)OCC)CCC2

STK854864
Synonyms: N-(3-fluorophenyl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: Fc1cccc(c1)Nc1ncnc2c1c1CCCc1s2

STK854865
Synonyms: (5Z)-1-(3-ethoxyphenyl)-5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1cccc(c1)N1C(=NC(=O)/C(=C/c2ccc(o2)c2cc(ccc2C)[N+](=O)[O-])/C1=O)S

STK854866
Synonyms: (4E)-5-(4-chlorophenyl)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854867
Synonyms: 2-(4-methoxyphenoxy)-N-(9-oxo-9H-xanthen-3-yl)acetamide
Smiles: COc1ccc(cc1)OCC(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1

STK854868
Synonyms: (5E)-3-(4-bromophenyl)-5-({1-[4-(dimethylamino)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}methylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Brc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cc(n(c2C)c2ccc(cc2)N(C)C)C)/C1=O)O

STK854869
Synonyms: 2-{[morpholin-4-yl(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(C(=O)Nc1sc2c(c1C(=O)N)CCCC2)N1CCOCC1

STK854871
Synonyms: (5Z)-3-(furan-2-ylmethyl)-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)Cc1ccco1

STK854873
Synonyms: 6-ethyl-2-(4-methoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: CCc1c(C)nc2n(c1O)nc(c2)c1ccc(cc1)OC

STK854874
Synonyms: 3-[(2,6-dimethylphenyl)amino]-6-methyl-1,2,4-triazin-5-ol
Smiles: Cc1cccc(c1Nc1nnc(c(n1)O)C)C

STK854876
Synonyms: N-(4-chlorophenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
Smiles: CC(c1ccc(cc1)CC(C)C)C(=O)Nc1ccc(cc1)Cl

STK854877
Synonyms: 1,7-dimethyl-8-[2-(morpholin-4-yl)ethyl]-3-(2-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1cn2c(n1CCN1CCOCC1)nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK854879
Synonyms: 8-(2-chlorophenyl)-1,6,7-trimethyl-3-(2-methylprop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)c1ccccc1Cl

STK854880
Synonyms: (4E)-5-(4-chlorophenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854881
Synonyms: 4-[2-(2-ethoxy-5-fluorophenyl)-2-oxoethyl]-2-ethyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCOc1ccc(cc1C(=O)CN1C(=O)C(CC)Oc2c(C1=O)cccc2)F

STK854882
Synonyms: N-(2-hydroxyethyl)-2-[(5E)-5-(4-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: OCCNC(=O)CN1C(=O)S/C(=C/c2ccc(cc2)OC)/C1=O

STK854883
Synonyms: (4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(pyridin-2-yl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccn1)Cc1cccnc1)/O

STK854884
Synonyms: 8-(2-chlorophenyl)-3-(3-hydroxypropyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)c1ccccc1Cl

STK854885
Synonyms: 3-(4-fluorobenzyl)-8-(furan-2-ylmethyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Fc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)Cc1ccco1

STK854886
Synonyms: N-(2-methoxyphenyl)-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Smiles: COc1ccccc1Nc1nc(C)nc2c1c1CCCCc1s2

STK854887
Synonyms: N-[(2E)-5-chloro-1,3-benzothiazol-2(3H)-ylidene]-3-methylbutanamide
Smiles: CC(CC(=O)/N=c\1/sc2c([nH]1)cc(cc2)Cl)C

STK854888
Synonyms: 2-{[7,7-dimethyl-2-(methylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]sulfanyl}ethanol
Smiles: OCCSc1nc(SC)nc2c1sc1c2COC(C1)(C)C

STK854889
Synonyms: 3,5-dimethoxy-N-[(2Z)-2-(propanoylimino)-2,3-dihydro-1,3-benzothiazol-6-yl]benzamide
Smiles: CCC(=O)/N=c\1/[nH]c2c(s1)cc(cc2)NC(=O)c1cc(OC)cc(c1)OC

STK854892
Synonyms: ethyl4-({[(4-amino-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nc(N)c2c(n1)sc1c2CCC1

STK854894
Synonyms: N-[(2Z)-5-(2-fluorophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-phenylbutanamide
Smiles: CCC(C(=O)/N=c\1/[nH]nc(s1)c1ccccc1F)c1ccccc1

STK854895
Synonyms: N-(naphthalen-1-yl)-2-[(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1ncnc2c1cnn2c1ccccc1

STK854897
Synonyms: 3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-2-hydroxyquinazolin-4(3H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)Cn1c(O)nc2c(c1=O)cccc2

STK854898
Synonyms: 3-(4-fluorobenzyl)-1,6,7-trimethyl[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)Cn1c(=O)c2n3c(nc2n(c1=O)C)oc(c3C)C

STK854899
Synonyms: 2-hydroxy-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)Cn1c(O)nc2c(c1=O)cccc2

STK854900
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-5-(2-methoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1ccccc1C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854902
Synonyms: (5E)-1-(3-bromophenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Brc1cccc(c1)N1C(=NC(=O)/C(=C\c2ccc(o2)c2ccccc2[N+](=O)[O-])/C1=O)S

STK854903
Synonyms: 3,7,9-trimethyl-1-(3-methylbutyl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC(CCN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)C)C

STK854904
Synonyms: 2-hydroxy-3-[6-oxo-6-(4-phenylpiperazin-1-yl)hexyl]quinazolin-4(3H)-one
Smiles: O=C(N1CCN(CC1)c1ccccc1)CCCCCn1c(O)nc2c(c1=O)cccc2

STK854905
Synonyms: 3,6,6-trimethyl-4-oxo-N-phenyl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)Nc1ccccc1

STK854907
Synonyms: 3-[(2E)-but-2-en-1-yl]-1,6,7-trimethyl-8-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: C/C=C/Cn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)CCN1CCOCC1

STK854909
Synonyms: (4E)-4-[(3,4-dimethoxyphenyl)(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1OC)/C(=C\1/C(c2ccc(cc2)C)N(C(=O)C1=O)c1noc(c1)C)/O

STK854910
Synonyms: 3-[(E)-2-(4,6-dihydroxy-5-nitropyrimidin-2-yl)ethenyl]-4H-chromen-4-one
Smiles: O=c1c(/C=C/c2nc(O)c(c(n2)O)[N+](=O)[O-])coc2c1cccc2

STK854911
Synonyms: (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-[3-(1H-imidazol-1-yl)propyl]-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C)CCCn1ccnc1)/O)C

STK854912
Synonyms: (4E)-4-[(4-bromophenyl)(hydroxy)methylidene]-5-(4-ethoxyphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Br)\O)/C(=O)C(=O)N1Cc1cccnc1

STK854913
Synonyms: (5E)-5-{[5-(3-chlorophenyl)furan-2-yl]methylidene}-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc(o2)c2cccc(c2)Cl)/C1=O)O

STK854915
Synonyms: 2-(1,6,7-trimethyl-2,4-dioxo-1,4-dihydro[1,3]oxazolo[2,3-f]purin-3(2H)-yl)acetamide
Smiles: NC(=O)Cn1c(=O)n(C)c2c(c1=O)n1c(n2)oc(c1C)C

STK854917
Synonyms: N-[(2E)-5-(1-phenylethyl)-1,3,4-thiadiazol-2(3H)-ylidene]cyclohexanecarboxamide
Smiles: CC(c1n[nH]/c(=N\C(=O)C2CCCCC2)/s1)c1ccccc1

STK854919
Synonyms: 6-(4-methoxyphenyl)-7-(thiophen-2-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1)C1Oc2ccccc2C2=C1C(c1cccs1)n1c(N2)ncn1

STK854920
Synonyms: N-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}benzenesulfonamide
Smiles: Cc1nn(c(c1)C)CCc1nc2c(n1C)ccc(c2)NS(=O)(=O)c1ccccc1

STK854921
Synonyms: methyl{3-[(E)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]-1H-indol-1-yl}acetate
Smiles: COC(=O)Cn1cc(c2c1cccc2)/C=C/1\C(=NC(=NC1=O)O)O

STK854924
Synonyms: 2-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)Cc1nn2c(n1)nc(c(c2C)Cl)C

STK854925
Synonyms: (2E)-3-[2-(difluoromethoxy)-5-nitrophenyl]-N-[(2E)-4-phenyl-1,3-thiazol-2(3H)-ylidene]prop-2-enamide
Smiles: FC(Oc1ccc(cc1/C=C/C(=O)/N=c\1/scc([nH]1)c1ccccc1)[N+](=O)[O-])F

STK854927
Synonyms: N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]propanamide
Smiles: CCC(=O)Nc1cccc(c1)c1csc(n1)C

STK854928
Synonyms: (5E)-3-(4-bromo-3-methylphenyl)-6-hydroxy-5-(4-hydroxy-3,5-dimethoxybenzylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(/C=C/2\C(=NC(=O)N(C2=O)c2ccc(c(c2)C)Br)O)cc(c1O)OC

STK854930
Synonyms: 2-[(1-hydroxybutan-2-yl)amino]-9-methyl-3-{(Z)-[4-oxo-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCC(Nc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)C)CO

STK854931
Synonyms: N-[(1E)-1-(3-bromophenyl)ethylidene]-4-phenylpiperazin-1-amine
Smiles: Brc1cccc(c1)/C(=N/N1CCN(CC1)c1ccccc1)/C

STK854932
Synonyms: 2-{[(2-hydroxyethyl)carbamoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Smiles: OCCNC(=O)Nc1sc2c(c1C(=O)N)CCC2

STK854933
Synonyms: 6-(4-chlorobenzyl)-3-[(3,5-dimethylphenyl)amino]-1,2,4-triazin-5-ol
Smiles: Clc1ccc(cc1)Cc1nnc(nc1O)Nc1cc(C)cc(c1)C

STK854935
Synonyms: N-(4-fluorophenyl)-2-{(2E)-4-oxo-2-[(2E)-(2-oxo-1,3-thiazolidin-4-ylidene)hydrazinylidene]-1,3-thiazolidin-5-yl}acetamide
Smiles: O=C(Nc1ccc(cc1)F)CC1S/C(=N/N=C/2\CSC(=O)N2)/NC1=O

STK854939
Synonyms: 3-(4-fluorophenyl)-1,7,9-trimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: Fc1ccc(cc1)C1=NN(C)c2n(C1)c1c(=O)n(C)c(=O)n(c1n2)C

STK854941
Synonyms: 9-(3-chlorophenyl)-1,7-dimethyl-3-propyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cccc(c1)Cl

STK854942
Synonyms: 1-(4-bromophenyl)-2-[(4-hydroxy-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1nc(O)c2c(n1)sc1c2CC(OC1)(C)C

STK854943
Synonyms: (2Z)-4-methyl-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2-(2,3,4-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1c(ccc(c1OC)OC)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCCC1)[O-]

STK854944
Synonyms: 1-[(4-methoxyphenyl)sulfonyl]-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1nccs1

STK854945
Synonyms: 2-(3-chlorophenyl)-5-{4-[(3-chlorophenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1cccc(c1)Cl)c1cccc(c1)Cl

STK854946
Synonyms: N-{3-[1-(furan-2-ylcarbonyl)-5-(2-hydroxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
Smiles: O=C(N1N=C(CC1c1ccccc1O)c1cccc(c1)NS(=O)(=O)C)c1ccco1

STK854948
Synonyms: 4-[2-(4-ethoxy-3-fluorophenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCOc1ccc(cc1F)C(=O)CN1C(=O)COc2c(C1=O)cccc2

STK854949
Synonyms: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3-methylbutyl)piperidine-4-carboxamide
Smiles: CC(CCNC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2)C

STK854952
Synonyms: methyl[3,9-dimethyl-7-(3-methylbutyl)-6,8-dioxo-6,7,8,9-tetrahydro[1,2,4]triazino[3,4-f]purin-1(4H)-yl]acetate
Smiles: COC(=O)CN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STK854953
Synonyms: (4E)-4-[hydroxy(4-methylphenyl)methylidene]-5-(3-hydroxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Oc1cccc(c1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1noc(c1)C

STK854954
Synonyms: 2-hydroxy-3,7,7-trimethyl-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Cn1c(O)nc2c(c1=O)sc1c2COC(C1)(C)C

STK854955
Synonyms: 2-(3,7,9-trimethyl-6,8-dioxo-6,7,8,9-tetrahydro[1,2,4]triazino[3,4-f]purin-1(4H)-yl)acetamide
Smiles: NC(=O)CN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)C

STK854957
Synonyms: methyl3-(1,7-dimethyl-2,4-dioxo-1,4-dihydro[1,3]oxazolo[2,3-f]purin-3(2H)-yl)propanoate
Smiles: COC(=O)CCn1c(=O)n(C)c2c(c1=O)n1cc(oc1n2)C

STK854958
Synonyms: (5E)-3-(4-ethylphenyl)-6-hydroxy-5-{[5-(morpholin-4-yl)furan-2-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: CCc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc(o2)N2CCOCC2)/C1=O)O

STK854959
Synonyms: 9-(4-fluorophenyl)-3,4a,5,6,7,8,8a,9-octahydro-2H-5,8-methanothiochromeno[2,3-d][1,3]thiazol-2-one
Smiles: Fc1ccc(cc1)C1C2C3CCC(C2Sc2c1sc(=O)[nH]2)C3

STK854960
Synonyms: N-[(2Z)-4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2(3H)-ylidene]thiophene-2-carboxamide
Smiles: O=C(c1cccs1)/N=c/1\scc([nH]1)c1ccc(cc1)S(=O)(=O)N1CCCCCC1

STK854961
Synonyms: 1-[(2Z)-5-cyclopentyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3-methoxyphenyl)urea
Smiles: COc1cccc(c1)NC(=O)/N=c\1/[nH]nc(s1)C1CCCC1

STK854962
Synonyms: 1-(3-fluorophenyl)-6-methoxy-2-[2-(morpholin-4-yl)ethyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)CCN1CCOCC1)c1cccc(c1)F

STK854969
Synonyms: 6-[(E)-2-(4-methylphenyl)ethenyl]-3-(pyrazin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Cc1ccc(cc1)/C=C/c1nn2c(s1)nnc2c1cnccn1

STK854970
Synonyms: methyl4-[(3E)-3-[hydroxy(3-methoxyphenyl)methylidene]-4,5-dioxo-1-(pyridin-2-yl)pyrrolidin-2-yl]benzoate
Smiles: COc1cccc(c1)/C(=C\1/C(c2ccc(cc2)C(=O)OC)N(C(=O)C1=O)c1ccccn1)/O

STK854972
Synonyms: 4-(2-chlorobenzyl)-N-[(E)-(2,5-dimethoxyphenyl)methylidene]piperazin-1-amine
Smiles: COc1ccc(c(c1)/C=N/N1CCN(CC1)Cc1ccccc1Cl)OC

STK854976
Synonyms: 4-[4-(4-chlorophenoxy)-3-methyl-1H-pyrazol-5-yl]benzene-1,3-diol
Smiles: Clc1ccc(cc1)Oc1c(C)n[nH]c1c1ccc(cc1O)O

STK854977
Synonyms: N-[(2E)-5-(2-iodophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-1,3-benzodioxole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)OCO2)/N=c/1\[nH]nc(s1)c1ccccc1I

STK854980
Synonyms: 1-(2,1,3-benzoxadiazol-4-ylsulfonyl)-N-(4-methoxyphenyl)piperidine-4-carboxamide
Smiles: COc1ccc(cc1)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1non2

STK854982
Synonyms: 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole
Smiles: FC(c1cccc(c1)n1nnnc1CSc1nnnn1c1ccccc1)(F)F

STK854983
Synonyms: (4E)-5-(2,5-dimethoxyphenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(c(c1)C1/C(=C(/c2ccco2)\O)/C(=O)C(=O)N1c1noc(c1)C)OC

STK854986
Synonyms: (4E)-4-{hydroxy[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1-(5-methyl-1,2-oxazol-3-yl)-5-phenylpyrrolidine-2,3-dione
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)c1noc(c1)C)/O

STK854991
Synonyms: (5E)-5-{[1-(4-chlorophenyl)-1H-pyrrol-2-yl]methylidene}-6-hydroxy-2-sulfanylpyrimidin-4(5H)-one
Smiles: SC1=NC(=O)/C(=C/c2cccn2c2ccc(cc2)Cl)/C(=N1)O

STK854992
Synonyms: 1-(4-ethoxyphenyl)-4-oxo-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]-1,4-dihydropyridazine-3-carboxamide
Smiles: CCOc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1

STK854993
Synonyms: (4E)-5-(4-fluorophenyl)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1Cc1cccnc1

STK854995
Synonyms: 2-{[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[(2E)-4-methyl-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: COc1ccc(cc1)c1nnc([nH]1)SCC(=O)/N=c\1/scc([nH]1)C

STK854996
Synonyms: 3-(2-fluorobenzyl)-1,6,7-trimethyl[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: Fc1ccccc1Cn1c(=O)n(C)c2c(c1=O)n1c(n2)oc(c1C)C

STK854998
Synonyms: 1-(2-methylphenyl)-3-[(2Z)-5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: Cc1ccc(c(c1)OCc1n[nH]/c(=N/C(=O)Nc2ccccc2C)/s1)C(C)C

STK854999
Synonyms: N-[(E)-(4-ethoxyphenyl)methylidene]-4-(4-methylphenyl)piperazin-1-amine
Smiles: CCOc1ccc(cc1)/C=N/N1CCN(CC1)c1ccc(cc1)C

STK855001
Synonyms: 2,4-dichloro-N-[(2E)-5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)/N=c/1\[nH]nc(s1)COc1cc(C)ccc1C(C)C

STK855002
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Cc1onc(c1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccc(cc1)[N+](=O)[O-]

STK855003
Synonyms: ethyl3-{3-[(Z)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Smiles: CCOC(=O)c1cccc(c1)n1c(C)cc(c1C)/C=C\1/C(=NC(=NC1=O)S)O

STK855004
Synonyms: N-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide
Smiles: OCCN1CCN(CC1)C(=O)Nc1sc2c(c1C#N)CC(OC2)(C)C

STK855005
Synonyms: 4-(4-butoxyphenyl)-1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: CCCCOc1ccc(cc1)C1SCC(=O)Nc2c1c(O)nn2C1CCOC(C1)(C)C

STK855007
Synonyms: methyl[1-methyl-8-(3-methylphenyl)-2,4-dioxo-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl]acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cccc(c1)C

STK855009
Synonyms: 6,6-dimethyl-2-(prop-2-en-1-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Smiles: C=CCSc1nc(O)c2c(n1)sc1c2CC(OC1)(C)C

STK855010
Synonyms: 2-(3-{(E)-[1-(2-fluorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-1-yl)-N-phenylacetamide
Smiles: O=C(Cn1cc(c2c1cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1F)S)Nc1ccccc1

STK855014
Synonyms: 8-(2-hydroxyethyl)-1,7-dimethyl-3-(2-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK855015
Synonyms: 4-methyl-2-[3-phenyl-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazole
Smiles: Cc1csc(n1)N1N=C(CC1c1cccs1)c1ccccc1

STK855016
Synonyms: 2-(3-methylphenyl)-4-phenyl-5-(thiophen-2-yl)-1H-imidazole
Smiles: Cc1cccc(c1)c1nc(c([nH]1)c1cccs1)c1ccccc1

STK855017
Synonyms: methyl2-{(3E)-3-[hydroxy(4-methoxyphenyl)methylidene]-4,5-dioxo-2-phenylpyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COc1ccc(cc1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)/O

STK855018
Synonyms: (2Z)-4-methyl-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])cc(c2c1O/C(=C\c1ccncc1)/C2=O)C

STK855019
Synonyms: 1,7-dimethyl-8-(3-methylphenyl)-3-(2-oxopropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1cccc(c1)C)C

STK855020
Synonyms: 1-(4-methylphenyl)-3-[(2Z)-5-(4-nitrobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: Cc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)Cc1ccc(cc1)[N+](=O)[O-]

STK855021
Synonyms: 1-[(2Z)-5-(furan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-methylphenyl)urea
Smiles: Cc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)c1ccco1

STK855024
Synonyms: ethyl(2Z)-4-methyl-2-{[(3-methyl-1-benzofuran-2-yl)carbonyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1s/c(=N\C(=O)c2oc3c(c2C)cccc3)/[nH]c1C

STK855025
Synonyms: (4E)-5-(3-fluorophenyl)-4-[(4-fluorophenyl)(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Fc1cccc(c1)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1c1noc(c1)C

STK855026
Synonyms: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2)NCc1cccnc1

STK855031
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-phenyl-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccccc1)Cc1cccnc1)/c1ccc2c(c1)OCCO2

STK855032
Synonyms: 3-[(2,3-dimethylphenyl)amino]-6-methyl-1,2,4-triazin-5-ol
Smiles: Cc1c(cccc1C)Nc1nnc(c(n1)O)C

STK855033
Synonyms: 1-(4-fluorophenyl)-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Fc1ccc(cc1)n1ccc(=O)c(n1)C(=O)/N=c\1/[nH]nc(s1)C

STK855037
Synonyms: 1-(4-{[1-(4-bromophenyl)-1H-tetrazol-5-yl]methoxy}phenyl)ethanone
Smiles: Brc1ccc(cc1)n1nnnc1COc1ccc(cc1)C(=O)C

STK855039
Synonyms: propan-2-yl4-(3-hydroxyphenyl)-2-methyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: CC(OC(=O)C1=C(C)N=c2n(C1c1cccc(c1)O)c1ccccc1[nH]2)C

STK855040
Synonyms: 5-{[(4-methylphenyl)sulfonyl]methyl}-1-[3-(trifluoromethyl)phenyl]-1H-tetrazole
Smiles: Cc1ccc(cc1)S(=O)(=O)Cc1nnnn1c1cccc(c1)C(F)(F)F

STK855042
Synonyms: 4-[2-(4-chlorophenyl)-2-oxoethyl]-2-(propan-2-yl)-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: Clc1ccc(cc1)C(=O)CN1C(=O)C(Oc2c(C1=O)cccc2)C(C)C

STK855044
Synonyms: N-butyl-N-(1,1-dioxidotetrahydrothiophen-3-yl)benzenesulfonamide
Smiles: CCCCN(S(=O)(=O)c1ccccc1)C1CCS(=O)(=O)C1

STK855045
Synonyms: (4E)-5-(2-fluorophenyl)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-[3-(1H-imidazol-1-yl)propyl]pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)CCCn1ccnc1)/O)C

STK855046
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(pyridin-4-yl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccncc1)Cc1cccnc1)/c1ccc2c(c1)OCCO2

STK855047
Synonyms: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: N#Cc1c(NC(=O)c2nn(ccc2=O)c2ccc(cc2)F)sc2c1CCCC2

STK855048
Synonyms: (5E)-3-(4-ethoxyphenyl)-6-hydroxy-5-(2-nitrobenzylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccccc2[N+](=O)[O-])/C1=O)O

STK855050
Synonyms: 4-(4-methylphenyl)-N-[(E)-(3-methylthiophen-2-yl)methylidene]piperazin-1-amine
Smiles: Cc1ccc(cc1)N1CCN(CC1)/N=C/c1sccc1C

STK855051
Synonyms: benzyl(1,7-dimethyl-2,4-dioxo-1,4-dihydro[1,3]oxazolo[2,3-f]purin-3(2H)-yl)acetate
Smiles: O=C(Cn1c(=O)c2n3cc(oc3nc2n(c1=O)C)C)OCc1ccccc1

STK855053
Synonyms: 1-[(4-benzylpiperazin-1-yl)carbonyl]-4,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)N1CCN(CC1)Cc1ccccc1

STK855055
Synonyms: 3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-(4-hydroxy-3-methoxyphenyl)-1,3-thiazolidin-4-one
Smiles: COc1cc(ccc1O)C1SCC(=O)N1c1c(C)n(n(c1=O)c1ccccc1)C

STK855057
Synonyms: N-{3-[5-(4-fluorophenyl)-1-(methoxyacetyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
Smiles: COCC(=O)N1N=C(CC1c1ccc(cc1)F)c1cccc(c1)NS(=O)(=O)C

STK855058
Synonyms: 1-[(4-tert-butylbenzyl)oxy]-3-(4-chlorophenyl)quinoxalin-2(1H)-one4-oxide
Smiles: Clc1ccc(cc1)c1c(=O)n(OCc2ccc(cc2)C(C)(C)C)c2c([n+]1[O-])cccc2

STK855059
Synonyms: 1-(4-chlorobenzyl)-3-(4-chlorophenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Smiles: Clc1ccc(cc1)Cn1c(=O)n(c2ccc(cc2)Cl)c(=O)c2c1sc1c2CCCC1

STK855060
Synonyms: 5-{[(4-fluorophenyl)sulfonyl]methyl}-1-phenyl-1H-tetrazole
Smiles: Fc1ccc(cc1)S(=O)(=O)Cc1nnnn1c1ccccc1

STK855062
Synonyms: N-(2,4-dimethoxyphenyl)-4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Smiles: COc1ccc(c(c1)OC)NC(=O)C1=C(C)NC(=O)NC1c1ccc(c(c1)OC)O

STK855063
Synonyms: 1-(4-methylphenyl)-3-[(2Z)-5-{[2-(prop-2-en-1-yl)phenoxy]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: C=CCc1ccccc1OCc1n[nH]/c(=N/C(=O)Nc2ccc(cc2)C)/s1

STK855066
Synonyms: N-[(2Z)-4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2(3H)-ylidene]thiophene-2-carboxamide
Smiles: O=c1oc2ccccc2cc1c1cs/c(=N\C(=O)c2cccs2)/[nH]1

STK855067
Synonyms: 4-methoxy-N-(9-oxo-9H-xanthen-3-yl)benzamide
Smiles: COc1ccc(cc1)C(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1

STK855068
Synonyms: (5Z)-6-hydroxy-5-{[1-(4-nitrophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-2-sulfanylpyrimidin-4(5H)-one
Smiles: SC1=NC(=O)/C(=C\c2cc(n(c2c2ccccc2)c2ccc(cc2)[N+](=O)[O-])c2ccccc2)/C(=N1)O

STK855069
Synonyms: methyl(1-methyl-2,4-dioxo-8-phenyl-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl)acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1

STK855072
Synonyms: (4E)-5-(4-fluorophenyl)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-[3-(1H-imidazol-1-yl)propyl]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)CCCn1cncc1)/O

STK855074
Synonyms: (2Z)-4-methyl-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yldimethylcarbamate
Smiles: O=C(N(C)C)Oc1cc2O/C(=C\c3ccncc3)/C(=O)c2c(c1)C

STK855076
Synonyms: ethyl(2E)-2-({[(4-amino-6-hydroxypyrimidin-2-yl)sulfanyl]acetyl}imino)-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1s/c(=N/C(=O)CSc2nc(N)cc(n2)O)/[nH]c1C

STK855078
Synonyms: ({[(E)-(2-chlorophenyl)methylidene]amino}oxy)[(4-methoxyphenyl)amino]methanone
Smiles: COc1ccc(cc1)NC(=O)O/N=C/c1ccccc1Cl

STK855079
Synonyms: 8-(3-chlorophenyl)-1,7-dimethyl-3-(2-oxopropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1cccc(c1)Cl)C

STK855081
Synonyms: methyl(1,7,8-trimethyl-2,4-dioxo-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl)acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)C)C

STK855082
Synonyms: 2-{[1-(4-bromophenyl)-1H-tetrazol-5-yl]methyl}-1,2-benzothiazol-3(2H)-one1,1-dioxide
Smiles: Brc1ccc(cc1)n1nnnc1CN1C(=O)c2c(S1(=O)=O)cccc2

STK855083
Synonyms: 2-{[2-(2,5-dichlorothiophen-3-yl)-2-oxoethyl]sulfanyl}-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SCC(=O)c2cc(sc2Cl)Cl)nc2c(c1=O)c1CCCc1s2

STK855084
Synonyms: 8-(2-hydroxyphenyl)-1,7-dimethyl-3-(2-methylprop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccccc1O)C

STK855085
Synonyms: (5Z)-6-hydroxy-3-(4-methylphenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C/c2ccc(o2)c2ccccc2[N+](=O)[O-])/C1=O)O

STK855086
Synonyms: 2-[3-(propan-2-yloxy)phenyl]-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]
Smiles: CC(Oc1cccc(c1)c1nn2c(n1)c1c(nc2)c2ccccc2CC21CCCCC2)C

STK855087
Synonyms: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[furan-2-yl(hydroxy)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)OC)/C(=C(/c2ccco2)\O)/C(=O)C1=O

STK855090
Synonyms: 1-[(2Z)-5-(3-bromobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-(2-methylphenyl)urea
Smiles: Brc1cccc(c1)Cc1n[nH]/c(=N/C(=O)Nc2ccccc2C)/s1

STK855092
Synonyms: 3-(2-chloro-6-fluorobenzyl)-8-(2-methoxyethyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1c(F)cccc1Cl

STK855094
Synonyms: (5E)-5-{[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(c(c2)Cl)Cl)C)/C(=N1)O

STK855096
Synonyms: 2-(3-nitrophenyl)-4-phenyl-5-(thiophen-2-yl)-1H-imidazole
Smiles: [O-][N+](=O)c1cccc(c1)c1[nH]c(c(n1)c1ccccc1)c1cccs1

STK855097
Synonyms: methyl2-({[1-(4-chlorophenyl)-4-oxo-1,4-dihydropyridazin-3-yl]carbonyl}amino)benzoate
Smiles: COC(=O)c1ccccc1NC(=O)c1nn(ccc1=O)c1ccc(cc1)Cl

STK855107
Synonyms: 7-tert-butyl-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: O=c1c2c(nc3n2cc([nH]3)C(C)(C)C)n(c(=O)n1C)C

STK855109
Synonyms: (4E)-5-(3-chlorophenyl)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)Cc1cccnc1)/O)C

STK855110
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-[3-(1H-imidazol-1-yl)propyl]pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccco2)\O)/C(=O)C(=O)N1CCCn1ccnc1

STK855111
Synonyms: 3-phenyl-2-sulfanyl-3,5,6,8-tetrahydro-4H-spiro[1-benzothieno[2,3-d]pyrimidine-7,1'-cyclohexan]-4-one
Smiles: Sc1nc2sc3c(c2c(=O)n1c1ccccc1)CCC1(C3)CCCCC1

STK855112
Synonyms: 4-[2-(4-fluorophenyl)-2-oxoethyl]-2-propyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCCC1Oc2ccccc2C(=O)N(C1=O)CC(=O)c1ccc(cc1)F

STK855113
Synonyms: 3-(3-hydroxypropyl)-2-[(2-oxo-1-propyl-2,3-dihydro-1H-indol-3-yl)methyl]quinazolin-4(3H)-one
Smiles: CCCN1C(=O)C(c2c1cccc2)Cc1nc2ccccc2c(=O)n1CCCO

STK855117
Synonyms: methyl[4-methyl-9-(4-methylbenzyl)-2-oxo-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-3-yl]acetate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)ccc1c2CN(CO1)Cc1ccc(cc1)C

STK855119
Synonyms: 6-benzyl-3-[(4-methoxyphenyl)amino]-1,2,4-triazin-5-ol
Smiles: COc1ccc(cc1)Nc1nnc(c(n1)O)Cc1ccccc1

STK855120
Synonyms: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2)Nc1cccc(c1)C(F)(F)F

STK855121
Synonyms: 9-(3-chloro-2-methylphenyl)-3-(2-methoxyethyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cccc(c1C)Cl

STK855133
Synonyms: 1-[3-(3,4-dimethoxyphenyl)-5-(4-ethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Smiles: CCc1ccc(cc1)C1CC(=NN1C(=O)C)c1ccc(c(c1)OC)OC

STK855135
Synonyms: 1'-ethyl-6-hydroxy-2'-methyl-6'-nitro-2-sulfanyl-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one
Smiles: CCN1c2ccc(cc2CC2(C1C)C(=NC(=NC2=O)S)O)[N+](=O)[O-]

STK855136
Synonyms: (2Z)-2-(2,3-dimethoxybenzylidene)-7-[(dimethylammonio)methyl]-4-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1c(cccc1OC)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+](C)C)[O-]

STK855138
Synonyms: (4E)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-5-(pyridin-2-yl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccccn1)Cc1cccnc1)/O

STK855139
Synonyms: 7-[(2E)-but-2-en-1-yl]-3,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: C/C=C/Cn1c(=O)n(C)c2c(c1=O)n1CC(=NNc1n2)C

STK855140
Synonyms: 3-(3,4-dichlorophenyl)-5,6-dimethyl-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Cc1ccc(cc1)C(=O)CSc1nc2sc(c(c2c(=O)n1c1ccc(c(c1)Cl)Cl)C)C

STK855143
Synonyms: N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-2-(pyridin-2-ylsulfanyl)acetamide
Smiles: O=C(/N=c\1/sc2c([nH]1)cccc2)CSc1ccccn1

STK855145
Synonyms: N-[5-(2-amino-2-oxoethyl)-4-oxo-3-phenyl-2-thioxoimidazolidin-1-yl]benzamide
Smiles: NC(=O)CC1C(=O)N(C(=S)N1NC(=O)c1ccccc1)c1ccccc1

STK855146
Synonyms: 2-chloro-N-(9-oxo-9H-xanthen-3-yl)benzamide
Smiles: O=C(c1ccccc1Cl)Nc1ccc2c(c1)oc1c(c2=O)cccc1

STK855148
Synonyms: N-(4-ethoxyphenyl)-2,3-dimethyl-1H-indole-5-carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)c1ccc2c(c1)c(C)c([nH]2)C

STK855149
Synonyms: N-(5-chloro-9-oxo-9H-xanthen-3-yl)-2-(4-fluorophenoxy)acetamide
Smiles: O=C(Nc1ccc2c(c1)oc1c(c2=O)cccc1Cl)COc1ccc(cc1)F

STK855150
Synonyms: 3-(2-chloro-6-fluorophenyl)-N-(4-methoxyphenyl)-5-methyl-1,2-oxazole-4-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(C)onc1c1c(F)cccc1Cl

STK855151
Synonyms: N,N'-1,3-benzothiazol-6-yl-2-ylidenebis(2-methylpropanamide)
Smiles: O=C(C(C)C)Nc1ccc2c(c1)s/c(=N\C(=O)C(C)C)/[nH]2

STK855152
Synonyms: 2-({[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]methyl}sulfanyl)-1-methyl-1H-benzimidazole
Smiles: Cc1ccc(c(c1)C)n1nnnc1CSc1nc2c(n1C)cccc2

STK855154
Synonyms: methyl4-[(3E)-3-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(5-methyl-1,2-oxazol-3-yl)-4,5-dioxopyrrolidin-2-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1/C(=C(/c2ccc(cc2)OC(C)C)\O)/C(=O)C(=O)N1c1noc(c1)C

STK855155
Synonyms: 1-(4-fluorophenyl)-N-{4-[methyl(phenyl)sulfamoyl]phenyl}-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Fc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1ccc(cc1)S(=O)(=O)N(c1ccccc1)C

STK855156
Synonyms: 2-[(1-benzyl-5-methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)methyl]-3-ethylquinazolin-4(3H)-one
Smiles: CCn1c(CC2C(=O)N(c3c2cc(C)cc3)Cc2ccccc2)nc2c(c1=O)cccc2

STK855157
Synonyms: 3-methyl-1-(morpholin-4-yl)-2-pentylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCc1c(C)c(C#N)c2n(c1N1CCOCC1)c1ccccc1n2

STK855159
Synonyms: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Cc1onc(c1)N1C(c2ccc(cc2)[N+](=O)[O-])/C(=C(/c2cc3c(o2)cccc3)\O)/C(=O)C1=O

STK855160
Synonyms: 7-[(3-ethylphenoxy)methyl]-1,3-dimethyl-6,7-dihydro[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: CCc1cccc(c1)OCC1Oc2n(C1)c1c(n2)n(C)c(=O)n(c1=O)C

STK855162
Synonyms: ethyl3-({[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)c1c(C)onc1c1c(F)cccc1Cl

STK855163
Synonyms: 1-(4-chlorophenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Clc1ccc(cc1)n1ncc2c1ncnc2N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

STK855164
Synonyms: 3-(2-methoxyethyl)-1,6,7-trimethyl[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1c(n2)oc(c1C)C

STK855165
Synonyms: N-(1-methyl-2-{[4-(2-methylpropanoyl)piperazin-1-yl]methyl}-1H-benzimidazol-5-yl)propanamide
Smiles: CCC(=O)Nc1ccc2c(c1)nc(n2C)CN1CCN(CC1)C(=O)C(C)C

STK855167
Synonyms: N-[5-oxo-2-phenyl-1-propyl-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]furan-2-carboxamide
Smiles: CCCN1C(=NC(C1=O)(NC(=O)c1ccco1)C(F)(F)F)c1ccccc1

STK855169
Synonyms: 2-{[(furan-2-ylmethyl)carbamoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(Nc1sc2c(c1C(=O)N)CCCC2)NCc1ccco1

STK855170
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N,N-dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)OC)CCC

STK855171
Synonyms: N-[(2Z)-6-chloro-1,3-benzothiazol-2(3H)-ylidene]-1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Fc1ccc(cc1)n1ccc(=O)c(n1)C(=O)/N=c/1\sc2c([nH]1)ccc(c2)Cl

STK855174
Synonyms: 2-(4-chlorobenzyl)-6-(furan-2-yl)pyridazin-3(2H)-one
Smiles: Clc1ccc(cc1)Cn1nc(ccc1=O)c1ccco1

STK855177
Synonyms: 6-(3,4-dimethoxyphenyl)-5-methyl-5,6-dihydrobenzimidazo[1,2-c]quinazoline
Smiles: COc1ccc(cc1OC)C1N(C)c2ccccc2c2n1c1ccccc1n2

STK855178
Synonyms: 1-methyl-7-[(4-nitrophenoxy)methyl]-6,7-dihydro[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: [O-][N+](=O)c1ccc(cc1)OCC1Cn2c(O1)nc1c2c(=O)[nH]c(=O)n1C

STK855179
Synonyms: 4-[2-(4-ethoxyphenyl)-2-oxoethyl]-2-(propan-2-yl)-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCOc1ccc(cc1)C(=O)CN1C(=O)C(Oc2c(C1=O)cccc2)C(C)C

STK855180
Synonyms: bis(2-methylpropyl)2-(4-tert-butylphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Smiles: CC(COC(=O)C1C(=O)CC(C(C1c1ccc(cc1)C(C)(C)C)C(=O)OCC(C)C)(C)O)C

STK855183
Synonyms: 2-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-d]pyrimidin-4-amine
Smiles: CSc1nc(NCCN2CCOCC2)c2c(n1)c1CCCCc1s2