FULL DB

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

STK628196
Synonyms: 3-{(E)-[3-(4-hydroxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methoxyquinolin-2(1H)-one
Smiles: COc1ccc2c(c1)[nH]c(=O)c(c2)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)O

STK628199
Synonyms: methyl3-{[2,3,5-trifluoro-6-(pyrrolidin-1-yl)pyridin-4-yl]oxy}benzoate
Smiles: COC(=O)c1cccc(c1)Oc1c(F)c(F)nc(c1F)N1CCCC1

STK628201
Synonyms: 2-{4-[(5,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]piperazin-1-yl}-N-[2-(dimethylamino)ethyl]acetamide
Smiles: COc1cc(OC)cc2c1c(C)c(c(=O)o2)CC(=O)N1CCN(CC1)CC(=O)NCCN(C)C

STK628202
Synonyms: (4E)-4-[furan-2-yl(hydroxy)methylidene]-5-(4-methoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccco2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK628203
Synonyms: 6-tert-butyl-2-[(2-fluorobenzyl)sulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile
Smiles: N#Cc1c(SCc2ccccc2F)nc(cc1C(F)(F)F)C(C)(C)C

STK628204
Synonyms: 3-(biphenyl-4-yloxy)-4-oxo-4H-chromen-7-yl3,4,5-trimethoxybenzoate
Smiles: COc1cc(cc(c1OC)OC)C(=O)Oc1ccc2c(c1)occ(c2=O)Oc1ccc(cc1)c1ccccc1

STK628206
Synonyms: 4-(2-chlorophenyl)-3-methyl-1-phenyl-1H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidine-5,7-diol
Smiles: Oc1nc(O)c2c(n1)nc1c(c2c2ccccc2Cl)c(nn1c1ccccc1)C

STK628207
Synonyms: 3-[(4S)-2,5-dioxo-1-(2-phenylethyl)imidazolidin-4-yl]-N-(4-fluorobenzyl)propanamide
Smiles: O=C(NCc1ccc(cc1)F)CC[C@@H]1NC(=O)N(C1=O)CCc1ccccc1

STK628208
Synonyms: (2Z)-7-[(dibutylammonio)methyl]-2-(3-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)OC)/C2=O)CCCC

STK628209
Synonyms: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]piperidine-3-carboxamide
Smiles: OC[C@H](C(C)C)NC(=O)C1CCCN(C1)S(=O)(=O)c1cccc2c1nsn2

STK628210
Synonyms: 5-chloro-N-(2-methylquinolin-8-yl)-2-(methylsulfonyl)pyrimidine-4-carboxamide
Smiles: Cc1ccc2c(n1)c(ccc2)NC(=O)c1nc(ncc1Cl)S(=O)(=O)C

STK628212
Synonyms: N-{(4E)-8-ethoxy-1,3-dimethyl-6-[4-(methylsulfanyl)phenyl]-4H-cyclohepta[c]furan-4-ylidene}-1,3-benzodioxol-5-amine
Smiles: CCOc1cc(c/c(=N\c2ccc3c(c2)OCO3)/c2c1c(C)oc2C)c1ccc(cc1)SC

STK628214
Synonyms: (2E)-7-{[butyl(methyl)ammonio]methyl}-2-[(1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C/c1cn(c3c1cccc3)C)/C2=O)C

STK628217
Synonyms: [4-(1H-benzimidazol-2-yl)piperidin-1-yl](5-chloro-1-benzofuran-2-yl)methanone
Smiles: Clc1ccc2c(c1)cc(o2)C(=O)N1CCC(CC1)c1nc2c([nH]1)cccc2

STK628218
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-4H-chromen-7-yl]oxy}-N-(pyridin-2-yl)acetamide
Smiles: O=C(Nc1ccccn1)COc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK628219
Synonyms: 7-(4-hydroxyphenyl)-4-(3-methoxyphenyl)-3-methyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: COc1cccc(c1)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)c1ccc(cc1)O

STK628220
Synonyms: 3-(4-fluorophenyl)-9-(furan-2-ylmethyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: Fc1ccc(cc1)c1cc2ccc3c(c2oc1=O)CN(CO3)Cc1ccco1

STK628221
Synonyms: 4-[2-(4-chlorophenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazol-1-yl]phenol
Smiles: Oc1ccc(cc1)n1c(cn2c1nc(c2c1ccccc1)c1ccccc1)c1ccc(cc1)Cl

STK628223
Synonyms: (5Z)-3-(2,4-dimethoxyphenyl)-5-(quinoxalin-5-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(OC)ccc1N1C(=S)S/C(=C\c2cccc3c2nccn3)/C1=O

STK628225
Synonyms: N-(2,4-dimethoxyphenyl)-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridazine-3-carboxamide
Smiles: COc1cc(OC)ccc1NC(=O)C1=NN(C(=O)CC1)c1ccccc1

STK628226
Synonyms: 7-{2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethoxy}spiro[chromene-2,1'-cyclohexan]-4(3H)-one
Smiles: Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)COc1ccc2c(c1)OC1(CC2=O)CCCCC1

STK628229
Synonyms: ethyl2-({(E)-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1N/C=C/1\C(=NN(C1=O)C1CCS(=O)(=O)C1)C

STK628231
Synonyms: (5E)-3-benzyl-5-(quinolin-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2ccc3c(n2)cccc3)/C(=O)N1Cc1ccccc1

STK628232
Synonyms: N-[3-(dimethylamino)propyl]-2-[(5Z)-2,4-dioxo-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]acetamide
Smiles: CN(CCCNC(=O)CN1C(=O)S/C(=C\c2cccs2)/C1=O)C

STK628233
Synonyms: methyl(3-{(Z)-[1-(2-ethylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-1-yl)acetate
Smiles: COC(=O)Cn1cc(c2c1cccc2)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1CC)S

STK628234
Synonyms: N-[3-(dimethylamino)propyl]-N'-[2-(piperidin-1-ylcarbonyl)phenyl]ethanediamide
Smiles: CN(CCCNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1)C

STK628235
Synonyms: N-[1-ethyl-2-oxo-3-(2-oxopropyl)-2,3-dihydro-1H-indol-3-yl]-2-methylpropanamide
Smiles: CCN1c2ccccc2C(C1=O)(CC(=O)C)NC(=O)C(C)C

STK628236
Synonyms: methyl[(2Z)-2-{[(4-methylphenyl)carbonyl]imino}-4-phenyl-2,3-dihydro-1,3-thiazol-5-yl]carbamate
Smiles: COC(=O)Nc1s/c(=N\C(=O)c2ccc(cc2)C)/[nH]c1c1ccccc1

STK628237
Synonyms: (2Z)-2-(1-benzofuran-2-ylmethylidene)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-4-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])cc(c2c1O/C(=C\c1cc3c(o1)cccc3)/C2=O)C

STK628241
Synonyms: N-(4-acetylphenyl)-3-(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanamide
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)Nc1ccc(cc1)C(=O)C

STK628242
Synonyms: 4-{2-[(2-chloro-7H-purin-6-yl)amino]ethyl}benzenesulfonamide
Smiles: Clc1nc(NCCc2ccc(cc2)S(=O)(=O)N)c2c(n1)nc[nH]2

STK628243
Synonyms: 4-(4-chlorophenyl)-2-[5-(2,4-dimethoxyphenyl)-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazole
Smiles: COc1cc(OC)ccc1C1CC(=NN1c1scc(n1)c1ccc(cc1)Cl)C

STK628247
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide
Smiles: COc1ccc(cc1OC)CCNC(=O)C1CCCN(C1)c1ccc(cn1)[N+](=O)[O-]

STK628248
Synonyms: 4-(1H-indol-3-yl)-N-[(2E)-4-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)-1,3-thiazol-2(3H)-ylidene]butanamide
Smiles: COc1ccc2c(c1)c(c1cs/c(=N/C(=O)CCCc3c[nH]c4c3cccc4)/[nH]1)c(n2C)C

STK628249
Synonyms: 3-cyclopropyl-1-(3,4-dimethoxybenzyl)-1-(furan-2-ylmethyl)thiourea
Smiles: COc1cc(ccc1OC)CN(C(=S)NC1CC1)Cc1ccco1

STK628250
Synonyms: (2E)-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C[NH+]1CCCC1)[O-])cn2CC

STK628253
Synonyms: methylN-[(2,4-dimethoxyphenyl)carbamoyl]-L-phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccc(cc1OC)OC

STK628254
Synonyms: methyl(3-{(Z)-[1-(3-ethoxyphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)acetate
Smiles: CCOc1cccc(c1)N1C(=O)N=C(/C(=C/c2cn(c3c2cccc3)CC(=O)OC)/C1=O)O

STK628255
Synonyms: 3-[(4S)-1-(4-methoxybenzyl)-2,5-dioxoimidazolidin-4-yl]-N-(pyridin-2-ylmethyl)propanamide
Smiles: COc1ccc(cc1)CN1C(=O)N[C@H](C1=O)CCC(=O)NCc1ccccn1

STK628256
Synonyms: 10-[(3-methoxyphenyl)carbonyl]-8-(tetrahydrofuran-2-ylmethyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1cccc(c1)C(=O)C1C2C(=O)N(C(=O)C2C2N1c1ccccc1C=C2)CC1CCCO1

STK628257
Synonyms: N-{(2S)-1-[(3-methoxyphenyl)amino]-1-oxopropan-2-yl}-1-(phenylsulfonyl)piperidine-3-carboxamide
Smiles: COc1cccc(c1)NC(=O)[C@@H](NC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1)C

STK628259
Synonyms: 2,2-dimethyl-5-(2-methylpropyl)-10-sulfanyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-ol
Smiles: CC(Cc1nc2sc3c(c2c2c1COC(C2)(C)C)nc(nc3O)S)C

STK628260
Synonyms: N-(4-{[4-(1H-indol-3-ylcarbonyl)piperazin-1-yl]sulfonyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

STK628261
Synonyms: 4-(2-fluorophenyl)-3-methyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: OC1=C2C(=Nc3c(C2c2ccccc2F)c(C)no3)CCC1

STK628265
Synonyms: 1-[(10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino]butan-2-ol
Smiles: CCC(CNc1nc2sc3c(c2c2n1ncn2)CC(OC3)(C)C)O

STK628266
Synonyms: 2-(4-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}-3-methylphenyl)-4-methyl-1,2-thiazolidin-3-one1,1-dioxide
Smiles: O=C1C(C)CS(=O)(=O)N1c1ccc(c(c1)C)S(=O)(=O)N1CCN(CC1)c1ccccc1F

STK628267
Synonyms: N-(1,3-dihydro-2H-benzimidazol-2-ylidene)-2-[(4-oxo-3-phenyl-4H-chromen-7-yl)oxy]acetamide
Smiles: O=C(/N=c/1\[nH]c2c([nH]1)cccc2)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK628269
Synonyms: 3-(4-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethyl}piperazin-1-yl)-1,2-benzothiazole
Smiles: C=CCc1ccc(c(c1)OC)OCCN1CCN(CC1)c1nsc2c1cccc2

STK628270
Synonyms: 7-methoxy-3-{(E)-[3-(3-methoxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}quinolin-2(1H)-one
Smiles: COc1cccc(c1)N1C(=S)S/C(=C/c2cc3ccc(cc3[nH]c2=O)OC)/C1=O

STK628272
Synonyms: 1-cyclopropyl-1-(furan-2-ylmethyl)-3-methylthiourea
Smiles: CNC(=S)N(C1CC1)Cc1ccco1

STK628273
Synonyms: 2-(5-{(E)-[1-(4-fluorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: Fc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc(o2)c2ccccc2C(=O)O)/C1=O)O

STK628274
Synonyms: N-ethyl-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]pyridine-4-carboxamide
Smiles: CCN(C(=O)c1ccncc1)Cc1cc2cc(OC)ccc2[nH]c1=O

STK628275
Synonyms: 4-(2,4-dichlorophenyl)-3-methyl-7-phenyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: Clc1ccc(c(c1)Cl)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)c1ccccc1

STK628276
Synonyms: 3-hydroxy-N-[4-(methylsulfanyl)-1-oxo-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)butan-2-yl]quinoxaline-1(2H)-carboxamide
Smiles: CSCCC(C(=O)NC1CCCc2c1cccc2)NC(=O)N1CC(=Nc2c1cccc2)O

STK628279
Synonyms: 1-[(4-methoxyphenyl)sulfonyl]-N-{2-oxo-2-[(pyridin-3-ylmethyl)amino]ethyl}piperidine-4-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NCC(=O)NCc1cccnc1

STK628281
Synonyms: (4E)-2-(4-chlorophenyl)-4-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)/C(=C/NCCCn2cncc2)/c2c(C1=O)cccc2

STK628283
Synonyms: 1,3-dimethyl-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H)-trione
Smiles: O=C(N1CCN(CC1)c1ccccc1)CC1C(=O)Nc2c1c(=O)n(c(=O)n2C)C

STK628284
Synonyms: 2-{[4-ethyl-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[(2E)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: CCn1c(SCC(=O)/N=c/2\[nH]nc(s2)C)nnc1CN1CCOCC1

STK628286
Synonyms: [4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl][2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazol-5-yl]methanone
Smiles: COc1cc(ccc1OC)c1nc(c(s1)C(=O)N1CCC(CC1)(O)c1ccc(cc1)Cl)C

STK628288
Synonyms: 2-[(2-chloroprop-2-en-1-yl)oxy]-7,8,9,10-tetrahydroazepino[2,1-b]quinazolin-12(6H)-one
Smiles: ClC(=C)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1

STK628289
Synonyms: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-[(4-methoxybenzyl)oxy]-4H-chromen-4-one
Smiles: COc1ccc(cc1)COc1cc2occ(c(=O)c2cc1CC)c1ccc2c(c1)OCCO2

STK628290
Synonyms: N-(2,4-dimethylphenyl)-2-{[3-(4-methoxyphenoxy)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetamide
Smiles: COc1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1ccc(cc1C)C

STK628291
Synonyms: 2-{4-[1-(3-fluorophenyl)-6-hydroxy-3-methyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy}acetamide
Smiles: NC(=O)COc1ccc(cc1)C1CC(=Nc2c1c(C)nn2c1cccc(c1)F)O

STK628292
Synonyms: methyl4-[5-hydroxy-7-(4-hydroxyphenyl)-3-methyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-4-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)c1ccc(cc1)O

STK628294
Synonyms: 2-(3-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(morpholin-4-yl)ethyl]-1,3-oxazol-5-amine
Smiles: Clc1cccc(c1)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCCN1CCOCC1

STK628296
Synonyms: 6-[4-(4-methoxyphenyl)-3-methyl-1H-pyrazol-5-yl]-2-methyl-3-[2-(morpholin-4-yl)ethoxy]phenol
Smiles: COc1ccc(cc1)c1c(C)n[nH]c1c1ccc(c(c1O)C)OCCN1CCOCC1

STK628297
Synonyms: 2-{4-[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]-3-oxobutyl}-1H-isoindole-1,3(2H)-dione
Smiles: CCCc1cc(=O)oc2c1ccc(c2C)OCC(=O)CCN1C(=O)c2c(C1=O)cccc2

STK628298
Synonyms: (2Z)-4-chloro-3-hydroxy-2-(4-methyl-1,3-thiazol-2-yl)but-2-enenitrile
Smiles: Cc1csc(n1)/C(=C(/CCl)\O)/C#N

STK628299
Synonyms: (4E)-1-[2-(diethylamino)ethyl]-4-[furan-2-yl(hydroxy)methylidene]-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCN(CCN1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1cc(OC)c(c(c1)OC)OC)CC

STK628300
Synonyms: (2Z)-7-[(3,5-dimethylpiperidinium-1-yl)methyl]-2-(1H-indol-3-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CC1C[NH+](CC(C1)C)Cc1c([O-])ccc2c1O/C(=C\c1c[nH]c3c1cccc3)/C2=O

STK628302
Synonyms: 2-[(4,6-dimethylquinazolin-2-yl)amino]-6-methyl-5-(3-methylbenzyl)pyrimidin-4-ol
Smiles: Cc1cccc(c1)Cc1c(C)nc(nc1O)Nc1nc(C)c2c(n1)ccc(c2)C

STK628303
Synonyms: 1-[(4-fluorophenyl)sulfonyl]-N-{2-[(3-hydroxyphenyl)amino]-2-oxoethyl}piperidine-3-carboxamide
Smiles: O=C(Nc1cccc(c1)O)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F

STK628307
Synonyms: methyl(2Z)-2-[(1,3-benzodioxol-5-ylcarbonyl)imino]-2,3-dihydro-1,3-benzothiazole-6-carboxylate
Smiles: COC(=O)c1ccc2c(c1)s/c(=N\C(=O)c1ccc3c(c1)OCO3)/[nH]2

STK628308
Synonyms: trans-4-({[(4-chlorophenyl)sulfonyl]amino}methyl)-N-{2-oxo-2-[(tetrahydrofuran-2-ylmethyl)amino]ethyl}cyclohexanecarboxamide
Smiles: O=C(CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)Cl)NCC1CCCO1

STK628309
Synonyms: 4-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-N-[4-(piperidin-1-yl)phenyl]benzenesulfonamide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)Nc2ccc(cc2)N2CCCCC2)S(=O)(=O)CC1(C)C

STK628310
Synonyms: (2Z)-2-(3,4-dimethoxybenzylidene)-7-[(dipropylammonio)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(c(c1)OC)OC)/C2=O)CCC

STK628311
Synonyms: 1-cyclopropyl-N-(1,1-dioxidotetrahydrothiophen-3-yl)-6,7-difluoro-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)NC1CCS(=O)(=O)C1)C1CC1

STK628312
Synonyms: 1-ethyl-3-phenyltetrahydro-1H-thieno[3,4-d]imidazole-2(3H)-thione5,5-dioxide
Smiles: CCN1C2CS(=O)(=O)CC2N(C1=S)c1ccccc1

STK628313
Synonyms: 1-[N-(tert-butoxycarbonyl)-L-alanyl]piperidine-4-carboxylicacid
Smiles: C[C@@H](C(=O)N1CCC(CC1)C(=O)O)NC(=O)OC(C)(C)C

STK628314
Synonyms: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Smiles: CCN1CCCC1CNC(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK628315
Synonyms: trans-N-{(2R)-1-[(1,1-dioxidotetrahydrothiophen-3-yl)amino]-1-oxopropan-2-yl}-4-({[(4-methylphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: O=C([C@H](NC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)C)C)NC1CCS(=O)(=O)C1

STK628317
Synonyms: (3E)-3-(4-hydroxy-3-methoxybenzylidene)-2-(propan-2-yl)-2,3-dihydro-4H-1,2-benzothiazin-4-one1,1-dioxide
Smiles: COc1cc(ccc1O)/C=C/1\C(=O)c2ccccc2S(=O)(=O)N1C(C)C

STK628318
Synonyms: (3R)-3-[(3-{[4-(pyridin-2-yl)piperazin-1-yl]carbonyl}piperidin-1-yl)carbonyl]-2,3-dihydro[1,3]thiazolo[2,3-a]isoindol-5(9bH)-one
Smiles: O=C(C1CCCN(C1)C(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1)N1CCN(CC1)c1ccccn1

STK628319
Synonyms: 2-[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(4-hydroxy-1,1-dioxidotetrahydrothiophen-3-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)F)NC1CS(=O)(=O)CC1O

STK628320
Synonyms: N-cyclohexyl-3-{(4S)-1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2,5-dioxoimidazolidin-4-yl}propanamide
Smiles: O=C(NC1CCCCC1)CC[C@@H]1NC(=O)N(C1=O)CCc1c[nH]c2c1cc(F)cc2

STK628321
Synonyms: 7-hydroxy-4-methyl-3-{3-[4-(4-methylquinolin-2-yl)piperazin-1-yl]-3-oxopropyl}-2H-chromen-2-one
Smiles: Oc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCN(CC1)c1cc(C)c2c(n1)cccc2

STK628324
Synonyms: 3-[(10aS)-7,8-dimethoxy-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-[2-(5-fluoro-1H-indol-3-yl)ethyl]propanamide
Smiles: COc1cc2CN3C(=O)N(C(=O)[C@@H]3Cc2cc1OC)CCC(=O)NCCc1c[nH]c2c1cc(F)cc2

STK628326
Synonyms: N,3-dimethyl-N-(1-methylpiperidin-4-yl)-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carboxamide
Smiles: CN1CCC(CC1)N(C(=O)c1cc2c(s1)n(nc2C)c1ccccc1)C

STK628328
Synonyms: 4-(4-hydroxyphenyl)-3-methyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: Oc1ccc(cc1)C1C2=C(O)CCCC2=Nc2c1c(C)no2

STK628329
Synonyms: (5Z)-5-{[(2,4-dimethoxyphenyl)amino]methylidene}-4-methyl-2,6-dioxo-1-[3-(2-oxopyrrolidin-1-yl)propyl]-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(C)/C(=C/Nc2ccc(cc2OC)OC)/C(=O)N(C1=O)CCCN1CCCC1=O

STK628330
Synonyms: (2Z)-8-(pyridin-4-ylmethyl)-2-(thiophen-2-ylmethylidene)-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
Smiles: O=C1/C(=C/c2cccs2)/Oc2c1ccc1c2CN(CO1)Cc1ccncc1

STK628338
Synonyms: 3'-ethyl-6'-hydroxy-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: CCN1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N1C2COCC1)[N+](=O)[O-])O

STK628341
Synonyms: 1-(4-chlorophenyl)-4-(4,5-dimethyl-1,3-thiazol-2-yl)-5-imino-2,5-dihydro-1H-pyrrol-3-ol
Smiles: Clc1ccc(cc1)N1CC(=C(C1=N)c1sc(c(n1)C)C)O

STK628342
Synonyms: (6Z)-6-[4-(benzyloxy)benzylidene]-5-imino-2-[2-oxo-2-(piperidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C(N1CCCCC1)Cc1nn2c(=NC(=O)/C(=C\c3ccc(cc3)OCc3ccccc3)/C2=N)s1

STK628345
Synonyms: 1-[(4-fluorophenyl)sulfonyl]-N-[3-(naphthalen-1-ylamino)-3-oxopropyl]piperidine-4-carboxamide
Smiles: O=C(Nc1cccc2c1cccc2)CCNC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F

STK628347
Synonyms: methylN-(2,3-dihydro-1H-indol-1-ylcarbonyl)-L-leucinate
Smiles: COC(=O)[C@@H](NC(=O)N1CCc2c1cccc2)CC(C)C

STK628348
Synonyms: 3-(2-methylpropyl)-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one
Smiles: CC(CN1COc2c(C1)c1oc(=O)c3c(c1cc2)CCC3)C

STK628349
Synonyms: N-[2-(2,5-dimethoxyphenyl)ethyl]-4-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)benzenesulfonamide
Smiles: COc1ccc(cc1CCNS(=O)(=O)c1ccc(cc1)N1C(=O)C(CS1(=O)=O)(C)C)OC

STK628350
Synonyms: N-[4-(benzylcarbamoyl)phenyl]-4-phenyltetrahydro-2H-pyran-4-carboxamide
Smiles: O=C(c1ccc(cc1)NC(=O)C1(CCOCC1)c1ccccc1)NCc1ccccc1

STK628354
Synonyms: methyl2-{(3E)-3-[hydroxy(3-methoxyphenyl)methylidene]-2-[4-(methoxycarbonyl)phenyl]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COc1cccc(c1)/C(=C\1/C(c2ccc(cc2)C(=O)OC)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)/O

STK628356
Synonyms: N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-1-[(4-chlorophenyl)sulfonyl]piperidine-4-carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)/N=c/1\sc2c([nH]1)cccc2

STK628357
Synonyms: [3-(4-chlorobenzyl)-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]aceticacid
Smiles: OC(=O)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)Cl

STK628359
Synonyms: N-(1,3-dihydro-2H-benzimidazol-2-ylidene)-2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]acetamide
Smiles: COc1cc(ccc1OC)c1scc(n1)CC(=O)/N=c/1\[nH]c2c([nH]1)cccc2

STK628360
Synonyms: 2-[(1'-acetyl-4-oxo-3,4-dihydrospiro[chromene-2,4'-piperidin]-7-yl)oxy]-N-(pyridin-3-yl)acetamide
Smiles: O=C(Nc1cccnc1)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C

STK628361
Synonyms: N-(2-ethoxyphenyl)-2-{[3-(4-methoxyphenyl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetamide
Smiles: CCOc1ccccc1NC(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)OC)C

STK628362
Synonyms: 2-[(2-methyl-4-oxo-3-phenyl-4H-chromen-7-yl)oxy]-N-(pyridin-2-yl)acetamide
Smiles: O=C(Nc1ccccn1)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK628364
Synonyms: 2-(4-methoxyphenyl)-4-methyl-6-(methylsulfanyl)pyrimidine-5-carbonitrile
Smiles: COc1ccc(cc1)c1nc(C)c(c(n1)SC)C#N

STK628365
Synonyms: 3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4-methyl-2-oxo-2H-chromen-7-ylacetate
Smiles: CC(=O)Oc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCc2c(C1)cccc2

STK628366
Synonyms: (2E)-3-(2,4-dichlorophenyl)-N-[(2E)-5-(ethylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]prop-2-enamide
Smiles: CCS(=O)(=O)c1n[nH]/c(=N\C(=O)/C=C/c2ccc(cc2Cl)Cl)/s1

STK628367
Synonyms: N-[(4E)-8-ethoxy-6-(4-methoxyphenyl)-1,3-dimethyl-4H-cyclohepta[c]furan-4-ylidene]-3-methoxyaniline
Smiles: CCOc1cc(c/c(=N\c2cccc(c2)OC)/c2c1c(C)oc2C)c1ccc(cc1)OC

STK628369
Synonyms: N-cyclopropyl-3-{(4S)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl}propanamide
Smiles: C[C@H](N1C(=O)N[C@H](C1=O)CCC(=O)NC1CC1)c1ccccc1

STK628370
Synonyms: 1-(4-acetylpiperazin-1-yl)-2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]ethanone
Smiles: COc1cc(ccc1OC)c1scc(n1)CC(=O)N1CCN(CC1)C(=O)C

STK628371
Synonyms: 1-[(4-oxoquinazolin-3(4H)-yl)acetyl]piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)Cn1cnc2c(c1=O)cccc2

STK628372
Synonyms: (4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(4-hydroxyphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: Oc1ccc(cc1)C1N(Cc2cccnc2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/O

STK628375
Synonyms: 4-(4,5-dimethyl-1,3-thiazol-2-yl)-5-imino-1-[3-(propan-2-yloxy)propyl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: CC(OCCCN1CC(=C(C1=N)c1sc(c(n1)C)C)O)C

STK628376
Synonyms: 2-{4-[5-cyano-8-(furan-2-yl)-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]piperazin-1-yl}-N-cyclohexyl-2-oxoacetamide
Smiles: N#Cc1c(nc(c2c1CC(C)(C)OC2)c1ccco1)N1CCN(CC1)C(=O)C(=O)NC1CCCCC1

STK628379
Synonyms: [4-(2-fluorophenyl)piperazin-1-yl](1H-indol-5-yl)methanone
Smiles: O=C(c1ccc2c(c1)cc[nH]2)N1CCN(CC1)c1ccccc1F

STK628380
Synonyms: (4E)-5-(4-chlorophenyl)-1-[2-(dimethylamino)ethyl]-4-{hydroxy[3-methyl-4-(2-methylpropoxy)phenyl]methylidene}pyrrolidine-2,3-dione
Smiles: CC(COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Cl)CCN(C)C)/O)C

STK628382
Synonyms: N-[(2E)-4-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)-1,3-thiazol-2(3H)-ylidene]-3-(4-methoxyphenyl)propanamide
Smiles: COc1ccc(cc1)CCC(=O)/N=c\1/scc([nH]1)c1c(C)n(c2c1cc(OC)cc2)C

STK628384
Synonyms: 2-[(5E)-5-{[5-fluoro-2-(methoxycarbonyl)-1H-indol-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-methylbutanoicacid
Smiles: COC(=O)c1[nH]c2c(c1/C=C\1/SC(=S)N(C1=O)C(C(=O)O)C(C)C)cc(cc2)F

STK628385
Synonyms: 5-benzyl-2-[(4,8-dimethylquinazolin-2-yl)amino]-6-methylpyrimidin-4-ol
Smiles: Cc1nc(Nc2nc(C)c3c(n2)c(C)ccc3)nc(c1Cc1ccccc1)O

STK628387
Synonyms: (3aS,6R)-2-(2-methoxyphenyl)-1-oxo-N-[4-(trifluoromethoxy)phenyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: COc1ccccc1N1C[C@@]23C(C1=O)C([C@@H](O3)C=C2)C(=O)Nc1ccc(cc1)OC(F)(F)F

STK628388
Synonyms: N-[2-(cycloheptylamino)-2-oxoethyl]-1-[(4-methoxyphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NCC(=O)NC1CCCCCC1

STK628389
Synonyms: 2-(3-methoxyphenyl)-5-(4-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc(cc1)C1Oc2ccccc2C2N1N=C(C2)c1cccc(c1)OC

STK628390
Synonyms: 8-{3-[(2-chlorophenyl)amino]propyl}-4-hydroxy-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Clc1ccccc1NCCCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK628391
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-4H-chromen-7-yl]oxy}-N-(pyridin-3-yl)acetamide
Smiles: O=C(Nc1cccnc1)COc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK628392
Synonyms: (4E)-5-(4-chlorophenyl)-4-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Cl)Cc1cccnc1)/O

STK628393
Synonyms: ethyl4-{4-hydroxy-2-imino-3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2,5-dihydro-1H-pyrrol-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CC(=C(C1=N)c1scc(n1)c1ccc(cc1)OC)O

STK628394
Synonyms: 2-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[2-(4-hydroxyphenyl)ethyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O)NCCc1ccc(cc1)O

STK628396
Synonyms: 1-(4-chlorophenyl)-3-methyl-4-(thiophen-2-yl)-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: Clc1ccc(cc1)n1nc(c2c1N=C(O)CC2c1cccs1)C

STK628398
Synonyms: 4-(1,3-benzodioxol-5-ylmethyl)-5-(furan-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1Cc1ccc2c(c1)OCO2)c1ccco1

STK628399
Synonyms: 9-methoxy-N,N-dimethyl-6H-indolo[2,3-b]quinoxaline-6-sulfonamide
Smiles: COc1ccc2c(c1)c1nc3ccccc3nc1n2S(=O)(=O)N(C)C

STK628400
Synonyms: 2-[(4,7-dimethylquinazolin-2-yl)amino]-6-methyl-5-propylpyrimidin-4-ol
Smiles: CCCc1c(C)nc(nc1O)Nc1nc(C)c2c(n1)cc(cc2)C

STK628401
Synonyms: N-(2,6-dichlorophenyl)-2-[(5-hydroxy-6-phenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide
Smiles: O=C(Nc1c(Cl)cccc1Cl)CSc1nnc(c(n1)O)c1ccccc1

STK628402
Synonyms: 2-(benzylsulfanyl)-1-(3-methoxybenzyl)-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole5,5-dioxide
Smiles: COc1cccc(c1)CN1C(=NC2C1CS(=O)(=O)C2)SCc1ccccc1

STK628404
Synonyms: 3-[4-imino-5,6-dimethyl-3-(pyridin-4-ylmethyl)-3,4-dihydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl]-N,N-dimethylpropan-1-amine
Smiles: CN(CCCn1c(C)c(c2c1ncn(c2=N)Cc1ccncc1)C)C

STK628405
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-4H-chromen-7-yl]oxy}-N-(5-methyl-1,3-thiazol-2-yl)acetamide
Smiles: O=C(Nc1ncc(s1)C)COc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK628406
Synonyms: 1-(furan-2-ylmethyl)-1-(4-methoxybenzyl)-3-[4-(propan-2-yl)phenyl]thiourea
Smiles: COc1ccc(cc1)CN(C(=S)Nc1ccc(cc1)C(C)C)Cc1ccco1

STK628410
Synonyms: N-(1H-benzimidazol-2-yl)-1-[(4-chlorophenyl)sulfonyl]piperidine-3-carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)Nc1nc2c([nH]1)cccc2

STK628412
Synonyms: 6-(2-chlorophenyl)-2-[(4,8-dimethylquinazolin-2-yl)amino]pyrimidin-4-ol
Smiles: Oc1nc(Nc2nc(C)c3c(n2)c(C)ccc3)nc(c1)c1ccccc1Cl

STK628415
Synonyms: 2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]-N-(4-methylpyridin-2-yl)acetamide
Smiles: O=C(Nc1nccc(c1)C)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1

STK628416
Synonyms: N-(2-oxo-2-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]amino}ethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide
Smiles: O=C(CNC(=O)c1ccc2c(c1)c(on2)c1ccccc1)NCc1onc(n1)c1ccccc1

STK628417
Synonyms: 3-methyl-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: COc1c(OC)cc(cc1OC)C1C2=C(O)CCCC2=Nc2c1c(C)no2

STK628418
Synonyms: 2-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nc(Cl)nc2c1[nH]cn2)OC

STK628421
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(4-methoxyphenyl)-N-[2-(morpholin-4-yl)ethyl]-1,3-oxazol-5-amine
Smiles: COc1ccc(cc1)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCCN1CCOCC1

STK628429
Synonyms: 3-[(5Z)-5-(furan-2-ylmethylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2-oxo-2H-chromen-6-yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)ccc(=O)o2)CCN1C(=O)S/C(=C\c2ccco2)/C1=O

STK628431
Synonyms: 4-phenyl-N-{4-[(1-phenylethyl)carbamoyl]phenyl}tetrahydro-2H-pyran-4-carboxamide
Smiles: CC(c1ccccc1)NC(=O)c1ccc(cc1)NC(=O)C1(CCOCC1)c1ccccc1

STK628432
Synonyms: 2-(4-methoxyphenoxy)-N-(1-methyl-2-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-1H-benzimidazol-5-yl)acetamide
Smiles: COc1ccc(cc1)OCC(=O)Nc1ccc2c(c1)nc(n2C)CSc1nccc(n1)C

STK628433
Synonyms: 1-[3,5-di(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-hydroxyethyl)amino]ethanone
Smiles: OCCNCC(=O)N1N=C(CC1c1cccs1)c1cccs1

STK628434
Synonyms: N-{4-[2-(4-methylphenyl)-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(Nc2c(C1=O)cccc2)c1ccc(cc1)C

STK628435
Synonyms: (2Z)-2-[(5-bromo-1-benzofuran-2-yl)methylidene]-7-{[butyl(methyl)ammonio]methyl}-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cc3c(o1)ccc(c3)Br)/C2=O)C

STK628436
Synonyms: N-[2-(2-fluorophenyl)ethyl]-1-[3-(1H-indol-3-yl)propanoyl]piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)CCc1c[nH]c2c1cccc2)NCCc1ccccc1F

STK628440
Synonyms: 1-cyclopropyl-N-(2,4-dimethoxybenzyl)-6,7-difluoro-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: COc1ccc(c(c1)OC)CNC(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2OC)F)F

STK628441
Synonyms: 4-(4,5-dimethyl-1,3-thiazol-2-yl)-5-imino-1-(2-methoxybenzyl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1ccccc1CN1CC(=C(C1=N)c1sc(c(n1)C)C)O

STK628442
Synonyms: 3-hydroxy-N-[(5Z)-4-oxo-5-(quinoxalin-5-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: Oc1cccc(c1)C(=O)NN1C(=S)S/C(=C\c2cccc3c2nccn3)/C1=O

STK628447
Synonyms: 2-{3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-1-hydroxy-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#Cc1c(C)c(CCC(=O)N2CCN(CC2)c2cccc(c2)Cl)c(n2c1nc1c2cccc1)O

STK628448
Synonyms: 5-amino-1-(4-methoxyphenyl)-N-(2-phenylpropyl)-1H-1,2,3-triazole-4-carboxamide
Smiles: COc1ccc(cc1)n1nnc(c1N)C(=O)NCC(c1ccccc1)C

STK628449
Synonyms: (5Z)-1-(4-chlorophenyl)-5-[(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C/C2C(=NN(C2=O)c2ccccc2)C)/C1=O)S

STK628451
Synonyms: 5-(3-chlorobenzyl)-6-methyl-2-[(4-methylquinazolin-2-yl)amino]pyrimidin-4-ol
Smiles: Clc1cccc(c1)Cc1c(C)nc(nc1O)Nc1nc(C)c2c(n1)cccc2

STK628452
Synonyms: methyl4,5-dimethyl-2-({[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]acetyl}amino)thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)COc2ccc3c(c2)oc(=O)c2c3cccc2)sc(c1C)C

STK628453
Synonyms: 3-[3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoicacid
Smiles: COc1cc(ccc1OC)C1N(CCC(=O)O)C(=O)C(=C1C(=O)C)O

STK628455
Synonyms: N-[(2Z)-3-(3-butoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: CCCCOc1cccc(c1)N1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK628457
Synonyms: 2-benzyl-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-ol
Smiles: Oc1nc2sc3c(c2c2n1nc(n2)Cc1ccccc1)CC(OC3)(C)C

STK628459
Synonyms: 1-cyclopropyl-3-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-6,7-difluoro-8-methoxyquinolin-4(1H)-one
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)N1CCc2c(C1)cccc2)C1CC1

STK628460
Synonyms: 7-(2-oxo-2-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}ethoxy)-4-phenyl-2H-chromen-2-one
Smiles: O=c1oc2cc(OCC(=O)N3CCN(CC3)CCc3ccccn3)ccc2c(c1)c1ccccc1

STK628462
Synonyms: (2E)-3-[(3,4-dimethoxyphenyl)amino]-2-[(4-methoxyphenyl)sulfonyl]prop-2-enenitrile
Smiles: COc1ccc(cc1)S(=O)(=O)/C(=C/Nc1ccc(c(c1)OC)OC)/C#N

STK628463
Synonyms: N-(3,5-dichlorophenyl)-7H-purin-6-amine
Smiles: Clc1cc(cc(c1)Cl)Nc1ncnc2c1[nH]cn2

STK628465
Synonyms: N-{2-[5-(acetylamino)-1-methyl-1H-benzimidazol-2-yl]ethyl}-3-chloro-4-fluorobenzamide
Smiles: CC(=O)Nc1ccc2c(c1)nc(n2C)CCNC(=O)c1ccc(c(c1)Cl)F

STK628466
Synonyms: 5-(2,4-difluorophenyl)-4-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(c(c1)F)c1n[nH]c(=S)n1c1cccnc1

STK628468
Synonyms: N-[(2E)-6-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-1,3-benzothiazol-2(3H)-ylidene]-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c\1/sc2c([nH]1)ccc(c2)C(=O)N1CCc2c(C1)cccc2

STK628472
Synonyms: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-N'-[2-(morpholin-4-ylcarbonyl)phenyl]ethanediamide
Smiles: COc1ccc(cc1)C(c1c[nH]c2c1cccc2)CNC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1

STK628473
Synonyms: N-[2-(4-hydroxyphenyl)ethyl]-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1ccc(cn1)[N+](=O)[O-])NCCc1ccc(cc1)O

STK628474
Synonyms: 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-(heptan-2-yl)-5-imino-2,5-dihydro-1H-pyrrol-3-ol
Smiles: CCCCCC(N1CC(=C(C1=N)c1scc(n1)c1ccc(c(c1)OC)OC)O)C

STK628475
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-4H-chromen-7-yl]oxy}-N-(pyridin-4-yl)acetamide
Smiles: O=C(Nc1ccncc1)COc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK628478
Synonyms: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2-methylpropyl)piperidine-3-carboxamide
Smiles: CC(CNC(=O)C1CCCN(C1)S(=O)(=O)c1cccc2c1nsn2)C

STK628479
Synonyms: (5E)-5-{[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]methylidene}-3-(4-ethoxyphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc(o2)Sc2nc3c([nH]2)cccc3)/C1=O)O

STK628480
Synonyms: 2-chloro-N-(3,4-dimethoxybenzyl)-N-[3-(4-methoxyphenyl)-3-phenylpropyl]acetamide
Smiles: COc1ccc(cc1)C(c1ccccc1)CCN(C(=O)CCl)Cc1ccc(c(c1)OC)OC

STK628484
Synonyms: N-[(2Z)-5-[2-(benzylsulfanyl)phenyl]-1,3,4-thiadiazol-2(3H)-ylidene]-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)/N=c\1/[nH]nc(s1)c1ccccc1SCc1ccccc1

STK628487
Synonyms: 2-{[(3aR,5R,5aS,8aS,8bR)-2,2,7,7-tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl]methoxy}-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide(non-preferredname)
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)COC[C@H]1O[C@@H]2OC(O[C@@H]2[C@@H]2[C@H]1OC(O2)(C)C)(C)C

STK628488
Synonyms: 3,5,9-trimethyl-6-(3-oxo-3-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}propyl)-7H-furo[3,2-g]chromen-7-one
Smiles: O=C(N1CCN(CC1)CCc1ccccn1)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C

STK628490
Synonyms: 6-[(2,3-dihydro-1H-indol-1-ylcarbonyl)amino]hexanoicacid
Smiles: OC(=O)CCCCCNC(=O)N1CCc2c1cccc2

STK628492
Synonyms: N-(2-hydroxy-3-methoxypropyl)-1-{[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonyl}piperidine-3-carboxamide
Smiles: COCC(CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)N1CCCC1=O)O

STK628493
Synonyms: N'-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-phenyl-1,3-oxazol-5-yl]-N,N-dimethylethane-1,2-diamine
Smiles: CN(CCNc1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1)C

STK628496
Synonyms: 1-[2-(4-hydroxyphenyl)ethyl]-2,6-dimethyl-5-phenylpyrimidin-4(1H)-one
Smiles: Oc1ccc(cc1)CCn1c(C)nc(=O)c(c1C)c1ccccc1

STK628497
Synonyms: 9-ethyl-N-[(4E)-2-(thiophen-2-yl)-4H-chromen-4-ylidene]-9H-carbazol-3-amine
Smiles: CCn1c2ccc(cc2c2c1cccc2)/N=c/1\cc(oc2c1cccc2)c1cccs1

STK628501
Synonyms: tert-butyl[(trans-4-{[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl}cyclohexyl)methyl]carbamate
Smiles: COc1ccccc1N1CCN(CC1)C(=O)[C@@H]1CC[C@H](CC1)CNC(=O)OC(C)(C)C

STK628503
Synonyms: N-(3,4-dimethoxyphenyl)-2-[(2-methyl-4-oxo-3-phenyl-4H-chromen-7-yl)oxy]acetamide
Smiles: COc1cc(ccc1OC)NC(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK628506
Synonyms: 2-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]amino}ethanol
Smiles: OCCNc1nc(nc2c1c1CC(C)(C)OCc1s2)n1nc(cc1C)C

STK628508
Synonyms: 2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4-ol
Smiles: Oc1nc(nc2c1C1(CCCCC1)Cc1c2cccc1)c1ccccc1

STK628509
Synonyms: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(pyrimidin-2-ylamino)propan-1-one
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)CCNc1ncccn1

STK628510
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(2-fluorophenyl)-N-(propan-2-yl)-1,3-oxazol-5-amine
Smiles: CC(Nc1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1F)C

STK628511
Synonyms: 3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-(pyridin-4-ylmethyl)butanamide
Smiles: CC(C(n1nnc2c(c1=O)cccc2)C(=O)NCc1ccncc1)C

STK628513
Synonyms: (2E)-2-[(1-ethyl-1H-indol-3-yl)methylidene]-7-[(4-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C[NH+]1CCC(CC1)C)[O-]

STK628515
Synonyms: 2-(3,4-dimethylphenyl)-2-oxoethyl4-(4-methyl-1,3-dioxo-1,3-dihydro-2H-pyrrolo[3,4-c]quinolin-2-yl)benzoate
Smiles: O=C(c1ccc(cc1)N1C(=O)c2c(C1=O)c(C)nc1c2cccc1)OCC(=O)c1ccc(c(c1)C)C

STK628516
Synonyms: N-[(2E)-5-[(4-tert-butylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-ethoxybenzamide
Smiles: CCOc1cccc(c1)C(=O)/N=c/1\[nH]nc(s1)COc1ccc(cc1)C(C)(C)C

STK628517
Synonyms: 3-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-7-methoxy-4-methyl-2H-chromen-2-one
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCN(CC1)c1cccc(c1C)C

STK628518
Synonyms: (2E)-7-{[butyl(methyl)ammonio]methyl}-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C/c1cn(c3c1cc(OC)cc3)C)/C2=O)C

STK628519
Synonyms: (2Z)-7-{[benzyl(methyl)ammonio]methyl}-2-(2-chlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccccc1Cl)/C2=O)Cc1ccccc1

STK628521
Synonyms: N-[2-(6-{(Z)-[1-(4-iodophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-N-methylacetamide
Smiles: COc1c(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)I)c(CCN(C(=O)C)C)cc2c1OCO2

STK628522
Synonyms: 2-amino-1-(4-methoxybenzyl)-N-(prop-2-en-1-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)OC

STK628526
Synonyms: 3-{(4S)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl}-N-(9-ethyl-9H-carbazol-3-yl)propanamide
Smiles: CCn1c2ccc(cc2c2c1cccc2)NC(=O)CC[C@@H]1NC(=O)N(C1=O)[C@H](c1ccccc1)C

STK628527
Synonyms: N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(5-nitropyridin-2-yl)piperidine-4-carboxamide
Smiles: CCN1CCCC1CNC(=O)C1CCN(CC1)c1ccc(cn1)[N+](=O)[O-]

STK628529
Synonyms: (4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)C)N(C(=O)C1=O)c1noc(c1)C)/O

STK628531
Synonyms: methylN-{[4-(acetylamino)phenyl]sulfonyl}-N-phenyl-beta-alaninate
Smiles: COC(=O)CCN(S(=O)(=O)c1ccc(cc1)NC(=O)C)c1ccccc1

STK628532
Synonyms: N-benzyl-8-ethyl-2,9-dimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine
Smiles: CCc1sc2c(c1C)c1nc(nn1c(n2)NCc1ccccc1)C

STK628533
Synonyms: (4E)-5-(4-chlorophenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccc(cc1)Cl

STK628534
Synonyms: 1-(furan-2-ylmethyl)-1-[1-(4-methoxyphenyl)-3-methylbut-3-en-1-yl]-3-[4-(trifluoromethyl)phenyl]thiourea
Smiles: COc1ccc(cc1)C(N(C(=S)Nc1ccc(cc1)C(F)(F)F)Cc1ccco1)CC(=C)C

STK628539
Synonyms: 3-[(4S)-1-(1,3-benzodioxol-5-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-(3-chlorophenyl)propanamide
Smiles: O=C(Nc1cccc(c1)Cl)CC[C@@H]1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2

STK628543
Synonyms: 3-(4-chlorophenyl)-6-hexyl-5,9-dimethyl-7H-furo[3,2-g]chromen-7-one
Smiles: CCCCCCc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)Cl

STK628545
Synonyms: 1-(2-chloro-7H-purin-6-yl)-N-(3-phenylpropyl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)NCCCc1ccccc1

STK628547
Synonyms: N-(1,3-benzodioxol-5-yl)-4-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)benzenesulfonamide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)Nc2ccc3c(c2)OCO3)S(=O)(=O)CC1(C)C

STK628553
Synonyms: 4-(4,5-dimethyl-1,3-thiazol-2-yl)-5-imino-1-[2-(thiophen-2-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: OC1=C(c2sc(c(n2)C)C)C(=N)N(C1)CCc1cccs1

STK628555
Synonyms: N-(2,5-dimethylphenyl)-3-[(4S)-1-{[4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl]methyl}-2,5-dioxoimidazolidin-4-yl]propanamide
Smiles: COc1ccc(cc1)C1(CCOCC1)CN1C(=O)N[C@H](C1=O)CCC(=O)Nc1cc(C)ccc1C

STK628558
Synonyms: N-(4-{(5E)-5-[(6-methoxy-1H-indol-3-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}phenyl)acetamide
Smiles: COc1ccc2c(c1)[nH]cc2/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)NC(=O)C

STK628559
Synonyms: 1-(2-chloro-7H-purin-6-yl)-N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)NCc1noc(n1)c1ccccc1

STK628561
Synonyms: N'-(9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)-N,N-dimethylethane-1,2-diamine
Smiles: CN(CCNc1nc2sc3c(c2c2n1ncn2)CCC3)C

STK628562
Synonyms: 3-(2-methoxyphenyl)-3-phenyl-1-(4-phenylpiperazin-1-yl)propan-1-one
Smiles: COc1ccccc1C(c1ccccc1)CC(=O)N1CCN(CC1)c1ccccc1

STK628565
Synonyms: (2E)-N-benzyl-N-methyl-2-[(phenylsulfonyl)imino]-2,3-dihydro-1,3-benzothiazole-6-carboxamide
Smiles: O=C(c1ccc2c(c1)s/c(=N/S(=O)(=O)c1ccccc1)/[nH]2)N(Cc1ccccc1)C

STK628566
Synonyms: N-(1-benzylpiperidin-4-yl)-2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetamide
Smiles: O=C(NC1CCN(CC1)Cc1ccccc1)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1

STK628568
Synonyms: 1-{[1-(tert-butoxycarbonyl)piperidin-3-yl]carbonyl}piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)C(=O)C1CCCN(C1)C(=O)OC(C)(C)C

STK628569
Synonyms: 2-[(8-ethoxy-4-methylquinazolin-2-yl)amino]-6-methyl-5-(4-methylbenzyl)pyrimidin-4-ol
Smiles: CCOc1cccc2c1nc(Nc1nc(C)c(c(n1)O)Cc1ccc(cc1)C)nc2C

STK628570
Synonyms: methyl3-({[2-methyl-4-(4-methyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)phenyl]sulfonyl}amino)benzoate
Smiles: COC(=O)c1cccc(c1)NS(=O)(=O)c1ccc(cc1C)N1C(=O)C(CS1(=O)=O)C

STK628571
Synonyms: 1-(4-fluorophenyl)-4-(3-hydroxyphenyl)-3-phenyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: OC1=Nc2c(C(C1)c1cccc(c1)O)c(nn2c1ccc(cc1)F)c1ccccc1

STK628573
Synonyms: N-(4-{[(Z)-{5-cyano-4-methyl-1-[2-(morpholin-4-yl)ethyl]-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene}methyl]amino}phenyl)acetamide
Smiles: N#CC1=C(C)/C(=C/Nc2ccc(cc2)NC(=O)C)/C(=O)N(C1=O)CCN1CCOCC1

STK628574
Synonyms: N-(2-hydroxy-2-phenylethyl)-N'-{2-[(2-methoxyethyl)carbamoyl]phenyl}ethanediamide
Smiles: COCCNC(=O)c1ccccc1NC(=O)C(=O)NCC(c1ccccc1)O

STK628575
Synonyms: 2-{[3-(4-methoxyphenoxy)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}-N-(1-phenylethyl)acetamide
Smiles: COc1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)NC(c1ccccc1)C

STK628577
Synonyms: 4-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-N-[2-(2-methoxyphenyl)ethyl]-2-methylbenzenesulfonamide
Smiles: COc1ccccc1CCNS(=O)(=O)c1ccc(cc1C)N1C(=O)C(CS1(=O)=O)(C)C

STK628579
Synonyms: 3,5-dimethoxy-N-methyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1cc(OC)cc(c1)C(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)C

STK628580
Synonyms: 6-[(10aS)-7,8-dimethoxy-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(pyridin-2-ylmethyl)hexanamide
Smiles: COc1cc2CN3C(=O)N(C(=O)[C@@H]3Cc2cc1OC)CCCCCC(=O)NCc1ccccn1

STK628582
Synonyms: 4-(2-butoxyphenyl)-1-(3-fluorophenyl)-3-methyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: CCCCOc1ccccc1C1CC(=Nc2c1c(C)nn2c1cccc(c1)F)O

STK628584
Synonyms: N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)-6-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)hexanamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)CCCCCn1c(O)nc2c(c1=O)cccc2

STK628587
Synonyms: (2E,5E)-5-(2H-chromen-3-ylmethylidene)-3-(prop-2-en-1-yl)-2-(1,3-thiazol-2-ylimino)-1,3-thiazolidin-4-one
Smiles: C=CCN1/C(=N\c2nccs2)/S/C(=C/C2=Cc3c(OC2)cccc3)/C1=O

STK628588
Synonyms: 6-[(4-benzylpiperidin-1-yl)carbonyl]-2-phenyl-4,5-dihydropyridazin-3(2H)-one
Smiles: O=C(C1=NN(C(=O)CC1)c1ccccc1)N1CCC(CC1)Cc1ccccc1

STK628589
Synonyms: (2E)-2-{[(4-chlorophenyl)sulfonyl]imino}-N-cyclopropyl-2,3-dihydro-1,3-benzothiazole-6-carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)/N=c\1/sc2c([nH]1)ccc(c2)C(=O)NC1CC1

STK628590
Synonyms: trans-N-[2-(cyclopentylamino)-2-oxoethyl]-4-{[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: O=C(NC1CCCC1)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1

STK628591
Synonyms: 1,6,7-trimethyl-8-[3-(morpholin-4-yl)propyl]-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)CCCN1CCOCC1

STK628593
Synonyms: (4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-(pyridin-3-ylmethyl)-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Smiles: Cc1cccc(c1)COc1ccc(cc1)/C(=C\1/C(c2cccs2)N(C(=O)C1=O)Cc1cccnc1)/O

STK628594
Synonyms: (4E)-4-[(3,4-dimethoxyphenyl)(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1OC)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1noc(c1)C)/O

STK628597
Synonyms: 4-(2-methoxyphenyl)-3-methyl-7-phenyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: COc1ccccc1C1C2=C(O)CC(CC2=Nc2c1c(C)no2)c1ccccc1

STK628599
Synonyms: (4E)-4-{[4-(benzyloxy)-2-methylphenyl](hydroxy)methylidene}-5-(4-hydroxyphenyl)-1-[2-(morpholin-4-yl)ethyl]pyrrolidine-2,3-dione
Smiles: Oc1ccc(cc1)C1N(CCN2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OCc1ccccc1)/O

STK628600
Synonyms: N-(4-bromo-2-methylphenyl)-3-{(4S)-1-[2-(4-methoxyphenyl)ethyl]-2,5-dioxoimidazolidin-4-yl}propanamide
Smiles: COc1ccc(cc1)CCN1C(=O)N[C@H](C1=O)CCC(=O)Nc1ccc(cc1C)Br

STK628601
Synonyms: N-(2-methoxyethyl)-2-[2-(3,4,5-trimethoxyphenyl)-1,3-thiazol-4-yl]acetamide
Smiles: COCCNC(=O)Cc1csc(n1)c1cc(OC)c(c(c1)OC)OC

STK628602
Synonyms: 2-[(5E)-5-(2-chlorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[(3S,4R)-4-hydroxytetrahydrothiophen-3-yl]acetamide
Smiles: O=C(CN1C(=O)S/C(=C/c2ccccc2Cl)/C1=O)N[C@@H]1CSC[C@@H]1O

STK628604
Synonyms: (5E)-5-[(6-hydroxy[1,3]dioxolo[4,5-g]quinolin-7-yl)methylidene]-3-phenyl-1,3-thiazolidine-2,4-dione
Smiles: O=C1S/C(=C/c2cc3cc4OCOc4cc3nc2O)/C(=O)N1c1ccccc1

STK628605
Synonyms: 3-fluoro-1',3',7,9,9-pentamethyl-6a,7,8,9,10,11-hexahydro-2'H,5H-spiro[7,11-methanoazepino[1,2-a]quinoline-6,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: Fc1ccc2c(c1)CC1(C3N2C2CC(CC3(C2)C)(C)C)C(=O)N(C)C(=O)N(C1=O)C

STK628607
Synonyms: 3-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-methylquinazolin-4(3H)-one
Smiles: COc1cc(ccc1OC)c1noc(n1)Cn1c(C)nc2c(c1=O)cccc2

STK628608
Synonyms: 5-amino-N-(2-chlorobenzyl)-1-(5-chloro-2-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Smiles: Clc1ccc(c(c1)n1nnc(c1N)C(=O)NCc1ccccc1Cl)C

STK628609
Synonyms: trans-N-[(2S)-1-{[2-(dimethylamino)ethyl]amino}-1-oxopropan-2-yl]-4-({[(4-fluorophenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: CN(CCNC(=O)[C@@H](NC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)F)C)C

STK628610
Synonyms: N-[(5Z)-4-oxo-5-(quinolin-8-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]pyridine-4-carboxamide
Smiles: S=C1S/C(=C\c2cccc3c2nccc3)/C(=O)N1NC(=O)c1ccncc1

STK628614
Synonyms: (3aS,6R)-N-cyclopropyl-2-(5-methyl-1,2-oxazol-3-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: O=C(C1[C@@H]2C=C[C@@]3(C1C(=O)N(C3)c1noc(c1)C)O2)NC1CC1

STK628616
Synonyms: 5-imino-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-[2-(morpholin-4-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)CCN1CCOCC1

STK628617
Synonyms: 1-[(4-chlorophenyl)sulfonyl]-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)S(=O)(=O)c1ccc(cc1)Cl)NCC(=O)N1CCCC1

STK628620
Synonyms: N-(2,4-dimethoxyphenyl)-2-methoxy-5-(4-methyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)benzenesulfonamide
Smiles: COc1ccc(c(c1)OC)NS(=O)(=O)c1cc(ccc1OC)N1C(=O)C(CS1(=O)=O)C

STK628621
Synonyms: 1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-N-(3-hydroxyphenyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)Nc1cccc(c1)O

STK628622
Synonyms: (3-methyl-1-benzofuran-2-yl){4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}methanone
Smiles: O=C(c1oc2c(c1C)cccc2)N1CCN(CC1)CCc1ccccn1

STK628624
Synonyms: 1-[(4-chlorophenyl)sulfonyl]-N-(quinolin-5-yl)piperidine-4-carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc2c1cccn2

STK628625
Synonyms: 8-{[cyclohexyl(methyl)amino]methyl}-7-hydroxy-4-phenyl-2H-chromen-2-one
Smiles: CN(C1CCCCC1)Cc1c(O)ccc2c1oc(=O)cc2c1ccccc1

STK628626
Synonyms: 3-{3-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-oxopropyl}-7-methoxy-4-methyl-2H-chromen-2-one
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCC(CC1)c1nc2c([nH]1)cccc2

STK628627
Synonyms: N-(4-ethylphenyl)-4-(4-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: CCc1ccc(cc1)NC(=S)c1n2nc(n3c2c(c1c1ccc(cc1)OC)CCCC3)c1ccccc1

STK628628
Synonyms: trans-4-({[(4-fluorophenyl)sulfonyl]amino}methyl)-N-{2-[(furan-2-ylmethyl)amino]-2-oxoethyl}cyclohexanecarboxamide
Smiles: O=C(NCc1ccco1)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)F

STK628629
Synonyms: 7-hydroxy-4-methyl-3-(3-oxo-3-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}propyl)-2H-chromen-2-one
Smiles: Oc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCN(CC1)CCc1ccncc1

STK628631
Synonyms: (2Z)-7-[(dibutylammonio)methyl]-2-(2,6-dichlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1c(Cl)cccc1Cl)/C2=O)CCCC

STK628632
Synonyms: 1-(3-chlorophenyl)-2-[(3-phenylpropyl)sulfanyl]-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole5,5-dioxide
Smiles: Clc1cccc(c1)N1C(=NC2C1CS(=O)(=O)C2)SCCCc1ccccc1

STK628635
Synonyms: (2E)-2-{[(4-chlorophenyl)sulfonyl]imino}-N-[2-(dimethylamino)ethyl]-2,3-dihydro-1,3-benzothiazole-6-carboxamide
Smiles: CN(CCNC(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)c1ccc(cc1)Cl)/[nH]2)C

STK628636
Synonyms: N-{2-[benzyl(methyl)amino]-2-oxoethyl}-1-(phenylsulfonyl)piperidine-3-carboxamide
Smiles: CN(C(=O)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1)Cc1ccccc1

STK628638
Synonyms: (2-{2-[(3,4-dichlorophenyl)amino]-2-oxoethoxy}phenyl)phosphonicacid
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)COc1ccccc1P(=O)(O)O

STK628639
Synonyms: 9-(2,4-dimethoxyphenyl)-1-methyl-3-[2-(piperidin-1-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cc(OC)ccc1N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK628641
Synonyms: 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-5-imino-1-(4-phenylbutan-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1cc(ccc1OC)c1csc(n1)C1=C(O)CN(C1=N)C(CCc1ccccc1)C

STK628642
Synonyms: 7-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethoxy}-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK628643
Synonyms: (4E)-5-(2,3-dimethoxyphenyl)-1-[3-(dimethylamino)propyl]-4-[hydroxy(5-methylfuran-2-yl)methylidene]pyrrolidine-2,3-dione
Smiles: COc1cccc(c1OC)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1CCCN(C)C

STK628644
Synonyms: 7-{2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethoxy}-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one
Smiles: Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK628645
Synonyms: 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-5-imino-1-[2-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1cc(ccc1OC)c1csc(n1)C1=C(O)CN(C1=N)c1ccccc1C(C)C

STK628646
Synonyms: 7-[(2-chloro-6-fluorobenzyl)oxy]-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one
Smiles: Fc1cccc(c1COc1ccc2c(c1)c(=O)n1c(n2)CCC1)Cl

STK628649
Synonyms: 4-methoxy-N-[(2E)-6-[(4-methylpiperazin-1-yl)carbonyl]-1,3-benzothiazol-2(3H)-ylidene]benzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c\1/sc2c([nH]1)ccc(c2)C(=O)N1CCN(CC1)C

STK628650
Synonyms: 5-oxo-1-(pyridin-3-ylmethyl)pyrrolidine-3-carboxamide
Smiles: NC(=O)C1CC(=O)N(C1)Cc1cccnc1

STK628651
Synonyms: 7-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-3-(3,4-dimethoxyphenyl)-4H-chromen-4-one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc(c2)OCC(=O)N1CCc2c(C1)cccc2

STK628652
Synonyms: (5E)-3-(furan-2-ylmethyl)-6-hydroxy-5-{[1-(3-methylbenzyl)-1H-pyrrol-2-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1cccc(c1)Cn1cccc1/C=C/1\C(=NC(=O)N(C1=O)Cc1ccco1)O

STK628655
Synonyms: 1-{[4-(acetylamino)phenyl]sulfonyl}-N-(naphthalen-1-yl)piperidine-3-carboxamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)Nc1cccc2c1cccc2

STK628656
Synonyms: 7-ethoxy-4-(morpholin-4-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCOc1ncnc2c1sc1c2c2CCCc2c(n1)N1CCOCC1

STK628657
Synonyms: trans-N-{2-[(2-chlorophenyl)amino]-2-oxoethyl}-4-{[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: O=C(Nc1ccccc1Cl)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1

STK628658
Synonyms: 8-(butan-2-yl)-10-[(4-chlorophenyl)carbonyl]-5-methyl-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: CCC(N1C(=O)C2C(C1=O)C(N1C2C=C(C)c2c1cccc2)C(=O)c1ccc(cc1)Cl)C

STK628661
Synonyms: 5-imino-4-(4-methyl-1,3-thiazol-2-yl)-1-[4-(morpholin-4-yl)phenyl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)c1ccc(cc1)N1CCOCC1

STK628664
Synonyms: 2-[(2-chloro-7H-purin-6-yl)amino]-1-(4-phenylpiperazin-1-yl)ethanone
Smiles: O=C(N1CCN(CC1)c1ccccc1)CNc1nc(Cl)nc2c1[nH]cn2

STK628667
Synonyms: (5Z)-5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-1-(4-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)C2CCCCC2)C)/C1=O)S

STK628668
Synonyms: 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-5-imino-1-(3-methylbutyl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1cc(ccc1OC)c1csc(n1)C1=C(O)CN(C1=N)CCC(C)C

STK628669
Synonyms: 7-methoxy-4-methyl-3-{3-oxo-3-[4-(pyrimidin-2-yl)piperazin-1-yl]propyl}-2H-chromen-2-one
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCN(CC1)c1ncccn1

STK628670
Synonyms: N-[3-(propan-2-yloxy)propyl]-2-(7H-purin-6-ylsulfanyl)propanamide
Smiles: CC(OCCCNC(=O)C(Sc1ncnc2c1[nH]cn2)C)C

STK628671
Synonyms: N-(3-acetylphenyl)-2-{[3-(2-methoxyphenoxy)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetamide
Smiles: COc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1cccc(c1)C(=O)C

STK628673
Synonyms: (2Z)-2-[(5-bromo-1-benzofuran-2-yl)methylidene]-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cc3c(o1)ccc(c3)Br)/C2=O

STK628678
Synonyms: N-[3-(dimethylamino)propyl]-1-[N-(phenylcarbonyl)glycyl]piperidine-4-carboxamide
Smiles: CN(CCCNC(=O)C1CCN(CC1)C(=O)CNC(=O)c1ccccc1)C

STK628680
Synonyms: (2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: Clc1cc(/C=C/2\Oc3c(C2=O)ccc(c3C[NH+]2CCOCC2)[O-])c2c(c1)COCO2

STK628681
Synonyms: (2Z)-2-(4-tert-butylbenzylidene)-7-[(diethylammonio)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)C(C)(C)C)/C2=O)CC

STK628683
Synonyms: N-[1-(2,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-N'-(2-hydroxyethyl)ethanediamide
Smiles: OCCNC(=O)C(=O)Nc1c(C)nn(c1C)Cc1ccc(cc1Cl)Cl

STK628685
Synonyms: (3Z)-6-chloro-1-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-3-[(1-methyl-1H-indol-3-yl)methylidene]-1,3-dihydro-2H-indol-2-one
Smiles: Clc1ccc2c(c1)N(CN1CCN(CC1)C(c1ccccc1)c1ccccc1)C(=O)/C/2=C\c1cn(c2c1cccc2)C

STK628686
Synonyms: (4E)-5-(2,5-dimethoxyphenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(c(c1)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1c1noc(c1)C)OC

STK628687
Synonyms: 2-(2,5-dimethyl-1H-pyrrol-1-yl)-N-(1,3-thiazol-2-yl)-1,3-benzothiazole-6-carboxamide
Smiles: O=C(c1ccc2c(c1)sc(n2)n1c(C)ccc1C)Nc1nccs1

STK628688
Synonyms: methyl4-{(E)-[1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-ylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\CC(=O)N(C1=O)c1cccc(c1)Cl

STK628690
Synonyms: trans-N-{2-[(furan-2-ylmethyl)amino]-2-oxoethyl}-4-{[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: O=C(NCc1ccco1)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1

STK628695
Synonyms: (3E)-2-benzyl-3-(pyridin-2-ylmethylidene)-2,3-dihydro-4H-1,2-benzothiazin-4-one1,1-dioxide
Smiles: O=C1/C(=C\c2ccccn2)/N(Cc2ccccc2)S(=O)(=O)c2c1cccc2

STK628697
Synonyms: 4-(4-hydroxyphenyl)-7-(4-methoxyphenyl)-3-methyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3c(C2c2ccc(cc2)O)c(no3)C)C1)O

STK628698
Synonyms: (2Z)-8-(2-methoxyphenyl)-2-(thiophen-2-ylmethylidene)-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
Smiles: COc1ccccc1N1COc2c(C1)c1O/C(=C\c3cccs3)/C(=O)c1cc2

STK628700
Synonyms: 3-[(5E)-5-(3-fluorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[3-(1H-imidazol-1-yl)propyl]propanamide
Smiles: O=C(CCN1C(=O)S/C(=C/c2cccc(c2)F)/C1=O)NCCCn1ccnc1

STK628701
Synonyms: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)OC)/C(=C(/c2ccc(o2)C)\O)/C(=O)C1=O

STK628703
Synonyms: (2Z)-7-(azepanium-1-ylmethyl)-2-[(5-bromo-1-benzofuran-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: Brc1ccc2c(c1)cc(o2)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCCCCC1)[O-]

STK628706
Synonyms: (6bS,9aR)-10-acetyl-3-methoxy-8-(prop-2-en-1-yl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: C=CCN1C(=O)[C@H]2[C@@H](C1=O)C(N1C2C=Cc2c1ccc(c2)OC)C(=O)C

STK628709
Synonyms: 4-(2,4-dimethoxyphenyl)-3-methyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: COc1ccc(c(c1)OC)C1C2=C(O)CCCC2=Nc2c1c(C)no2

STK628710
Synonyms: 5-(2,5-difluorophenyl)-4-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(c(c1)c1n[nH]c(=S)n1c1cccnc1)F

STK628713
Synonyms: N-[4-(furan-2-yl)butan-2-yl]-2-[(4-oxo-3,4-dihydrospiro[chromene-2,1'-cyclohexan]-7-yl)oxy]acetamide
Smiles: CC(NC(=O)COc1ccc2c(c1)OC1(CC2=O)CCCCC1)CCc1ccco1

STK628715
Synonyms: 1-(morpholin-4-yl)-2-(9H-[1,2,4]triazolo[4,3-a]benzimidazol-3-ylsulfanyl)ethanone
Smiles: O=C(N1CCOCC1)CSc1nnc2n1c1ccccc1[nH]2

STK628716
Synonyms: (4E)-5-(3-bromophenyl)-4-{hydroxy[2-methyl-4-(2-methylpropoxy)phenyl]methylidene}-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(c2cccc(c2)Br)/C(=C(/c2ccc(cc2C)OCC(C)C)\O)/C(=O)C1=O

STK628717
Synonyms: N-(3,4-dimethylphenyl)-3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1cc(OC)c(c(c1)OC)OC)c1ccc(c(c1)C)C

STK628718
Synonyms: (2Z)-7-[(dibutylammonio)methyl]-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(o1)C)/C2=O)CCCC

STK628719
Synonyms: 2-[(10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino]ethanol
Smiles: OCCNc1nc2sc3c(c2c2n1ncn2)CC(OC3)(C)C

STK628720
Synonyms: 8,10-diiodo-2,4-dimethyl-4-phenyl-5,6-dihydro-4H-benzo[d]cyclohepta[1,2-b:3,4-b']difuran
Smiles: Cc1oc2c(c1)C(C)(CCc1c2c2cc(I)cc(c2o1)I)c1ccccc1

STK628721
Synonyms: N-(4-bromophenyl)-N'-(3,4-dihydro-1H-isochromen-1-ylmethyl)butanediamide
Smiles: O=C(CCC(=O)Nc1ccc(cc1)Br)NCC1OCCc2c1cccc2

STK628722
Synonyms: 10,10-dimethyl-5-(pyrrolidin-1-yl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(s2)nc(n2c1ncn2)N1CCCC1

STK628723
Synonyms: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: C=CCOc1cccc(c1)C1/C(=C(/c2ccc(cc2)OC)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)CC

STK628726
Synonyms: (5E)-5-{[(4-tert-butylphenyl)amino]methylidene}-1-ethyl-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCN1C(=O)/C(=C/Nc2ccc(cc2)C(C)(C)C)/C(=C(C1=O)C#N)C

STK628728
Synonyms: 7-hydroxy-8-[(3-methoxyphenyl)(morpholin-4-yl)methyl]-4-methyl-2H-benzo[h]chromen-2-one
Smiles: COc1cccc(c1)C(c1ccc2c(c1O)ccc1c2oc(=O)cc1C)N1CCOCC1

STK628729
Synonyms: 8-butyl-5-methyl-10-[(3-nitrophenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: CCCCN1C(=O)C2C(C1=O)C(N1C2C=C(C)c2c1cccc2)C(=O)c1cccc(c1)[N+](=O)[O-]

STK628730
Synonyms: (5S)-3-(4-methoxybenzyl)-5-[3-oxo-3-(pyrrolidin-1-yl)propyl]imidazolidine-2,4-dione
Smiles: COc1ccc(cc1)CN1C(=O)N[C@H](C1=O)CCC(=O)N1CCCC1

STK628732
Synonyms: N-(pyridin-4-yl)-N'-(pyridin-2-ylmethyl)ethanediamide
Smiles: O=C(C(=O)Nc1ccncc1)NCc1ccccn1

STK628734
Synonyms: N-(2-{[(4-{[(2E)-4-methyl-1,3-thiazol-2(3H)-ylidene]carbamoyl}cyclohexyl)methyl]amino}-2-oxoethyl)benzamide
Smiles: O=C(CNC(=O)c1ccccc1)NCC1CCC(CC1)C(=O)/N=c\1/scc([nH]1)C

STK628735
Synonyms: (4E)-4-[hydroxy(4-propoxyphenyl)methylidene]-1-[3-(morpholin-4-yl)propyl]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccn1)CCCN1CCOCC1)/O

STK628736
Synonyms: 1-[3-(1H-indol-3-yl)propanoyl]-N-[2-(2-methoxyphenyl)ethyl]piperidine-3-carboxamide
Smiles: COc1ccccc1CCNC(=O)C1CCCN(C1)C(=O)CCc1c[nH]c2c1cccc2

STK628738
Synonyms: (4E)-5-(4-chlorophenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)Cl)/C(=C(/c2ccc(c(c2)C)OC)\O)/C(=O)C1=O

STK628739
Synonyms: N-[(2S)-4-(methylsulfanyl)-1-oxo-1-(pyridin-2-ylamino)butan-2-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1ccccn1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1

STK628742
Synonyms: (2E)-2-(2,7-dioxo-2,3-dihydropyrano[3,2-e]indol-1(7H)-ylidene)hydrazinecarbothioamide
Smiles: NC(=S)N/N=C\1/C(=O)Nc2c1c1ccc(=O)oc1cc2

STK628743
Synonyms: N-[2-(cyclopropylamino)-2-oxoethyl]-1-[(4-methoxyphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NCC(=O)NC1CC1

STK628745
Synonyms: 3,7,7-trimethyl-4-[4-(methylsulfanyl)phenyl]-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: CSc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)(C)C

STK628747
Synonyms: benzyl(1-{[(5E)-1,2,3,4,10,11-hexahydro-5H-spiro[benzo[c]pyrano[3,2-g]chromene-9,1'-cyclohexan]-5-ylideneamino]oxy}-1-oxopentan-2-yl)carbamate
Smiles: CCCC(C(=O)O/N=c\1/oc2cc3OC4(CCCCC4)CCc3cc2c2c1CCCC2)NC(=O)OCc1ccccc1

STK628748
Synonyms: 4-[1-(morpholin-4-ylmethyl)-1H-indol-3-yl]-1-(piperidin-1-yl)butan-1-one
Smiles: O=C(N1CCCCC1)CCCc1cn(c2c1cccc2)CN1CCOCC1

STK628750
Synonyms: 2'-(4-chlorophenyl)-7'-methoxy-2,2-dimethyl-1',2,3,5,6,10b'-hexahydrospiro[pyran-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: COc1cccc2c1OC1(CCOC(C1)(C)C)N1C2CC(=N1)c1ccc(cc1)Cl

STK628752
Synonyms: 6-chloro-7-hydroxy-4-phenyl-8-[(pyridin-3-ylamino)methyl]-2H-chromen-2-one
Smiles: O=c1cc(c2ccccc2)c2c(o1)c(CNc1cccnc1)c(c(c2)Cl)O

STK628753
Synonyms: 5-(1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-2-ethoxy-N-(pyridin-4-ylmethyl)benzenesulfonamide
Smiles: CCOc1ccc(cc1S(=O)(=O)NCc1ccncc1)N1C(=O)CCS1(=O)=O

STK628754
Synonyms: 7-(4-hydroxyphenyl)-3-methyl-4-(2,3,4-trimethoxyphenyl)-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: COc1ccc(c(c1OC)OC)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)c1ccc(cc1)O

STK628757
Synonyms: 1-{[2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazol-5-yl]carbonyl}piperidine-4-carboxamide
Smiles: COc1cc(ccc1OC)c1nc(c(s1)C(=O)N1CCC(CC1)C(=O)N)C

STK628759
Synonyms: 1-{[(2E)-2-{[(4-methoxyphenyl)sulfonyl]imino}-2,3-dihydro-1,3-benzothiazol-6-yl]carbonyl}piperidine-4-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c\1/sc2c([nH]1)ccc(c2)C(=O)N1CCC(CC1)C(=O)N

STK628760
Synonyms: 3-(4-chlorophenyl)-4-(2,4-difluorophenyl)-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: OC1=Nc2[nH]nc(c2C(C1)c1ccc(cc1F)F)c1ccc(cc1)Cl

STK628761
Synonyms: 4-(2,4-dichlorophenyl)-7-(4-methoxyphenyl)-3-methyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3c(C2c2ccc(cc2Cl)Cl)c(no3)C)C1)O

STK628762
Synonyms: N-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-(4-methoxyphenyl)-1H-pyrazol-5-yl]benzamide
Smiles: COc1ccc(cc1)c1nn(c(c1)NC(=O)c1ccccc1)C1CCS(=O)(=O)C1

STK628763
Synonyms: (4E)-4-{hydroxy[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: C=CCOc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)C)N(C(=O)C1=O)c1noc(c1)C)/O

STK628764
Synonyms: N-(2-phenylethyl)-N'-(2-phenyl-1H-indol-3-yl)ethanediamide
Smiles: O=C(C(=O)Nc1c([nH]c2c1cccc2)c1ccccc1)NCCc1ccccc1

STK628767
Synonyms: 2-[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-methyl-N-(1-methylpiperidin-4-yl)acetamide
Smiles: CN1CCC(CC1)N(C(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)F)C

STK628768
Synonyms: (5Z)-5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-1-(2-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\c1cc(n(c1C)c1cccnc1)C)c1ccccc1F

STK628770
Synonyms: 1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-N-(2-hydroxy-5-methylphenyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)Nc1cc(C)ccc1O

STK628772
Synonyms: ethyl1-(4-{[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]amino}butanoyl)piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)C(=O)CCCNC(=O)N1CC(=Nc2c1cccc2)O

STK628773
Synonyms: 3-[4-(morpholin-4-yl)phenyl]-2-(3-nitrophenyl)-2,3-dihydroquinazolin-4(1H)-one
Smiles: O=C1N(c2ccc(cc2)N2CCOCC2)C(Nc2c1cccc2)c1cccc(c1)[N+](=O)[O-]

STK628775
Synonyms: (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-5-(3-methoxyphenyl)-1-[2-(morpholin-4-yl)ethyl]pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)C1/C(=C(/c2ccc(cc2)OC(C)C)\O)/C(=O)C(=O)N1CCN1CCOCC1

STK628776
Synonyms: 2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]acetamide
Smiles: OC[C@H](C(C)C)NC(=O)Cc1csc(n1)c1ccc(c(c1)OC)OC

STK628777
Synonyms: N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-4-(1H-indol-3-yl)butanamide
Smiles: O=C(/N=c\1/sc2c([nH]1)cccc2)CCCc1c[nH]c2c1cccc2

STK628778
Synonyms: (2E)-2-{[(4-fluorophenyl)sulfonyl]imino}-N-(pyridin-4-ylmethyl)-2,3-dihydro-1,3-benzothiazole-6-carboxamide
Smiles: Fc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2c(s1)cc(cc2)C(=O)NCc1ccncc1

STK628779
Synonyms: (2Z)-2-(2,4-dimethoxybenzylidene)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1OC)OC)/C2=O

STK628780
Synonyms: N-(pyridin-4-yl)-N'-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]ethanediamide
Smiles: O=C(C(=O)Nc1ccncc1)NCc1c(C)nn(c1C)C

STK628781
Synonyms: N-(2-chlorophenyl)-2-[(4-oxo-3-phenyl-4H-chromen-7-yl)oxy]acetamide
Smiles: O=C(Nc1ccccc1Cl)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK628782
Synonyms: 2,3,5,6-tetrafluoro-4-[(2-hydroxyethyl)sulfanyl]benzoicacid
Smiles: OCCSc1c(F)c(F)c(c(c1F)F)C(=O)O

STK628783
Synonyms: 6-amino-2-({[1-(4-chlorophenyl)-1H-tetrazol-5-yl]methyl}sulfanyl)pyrimidin-4-ol
Smiles: Clc1ccc(cc1)n1nnnc1CSc1nc(N)cc(n1)O

STK628784
Synonyms: (4E)-1-[2-(diethylamino)ethyl]-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: CCN(CCN1C(c2ccc(cc2)O)/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\O)/C(=O)C1=O)CC

STK628785
Synonyms: (5Z)-6-hydroxy-5-{[5-(2-methyl-4-nitrophenyl)furan-2-yl]methylidene}-3-phenylpyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/c2ccc(o2)c2ccc(cc2C)[N+](=O)[O-])/C(=O)N1c1ccccc1

STK628786
Synonyms: N,N-dimethyl-2-(4-{[4-(propan-2-yl)phenyl]carbamothioyl}piperazin-1-yl)acetamide
Smiles: O=C(N(C)C)CN1CCN(CC1)C(=S)Nc1ccc(cc1)C(C)C

STK628787
Synonyms: 1-benzyl-2-hydroxy-5-(4-methylphenyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: Cc1ccc(cc1)c1ccnc2c1c(=O)nc(n2Cc1ccccc1)O

STK628789
Synonyms: methyl(2Z)-2-{[(2,3-dichlorophenyl)carbonyl]imino}-2,3-dihydro-1,3-benzothiazole-6-carboxylate
Smiles: COC(=O)c1ccc2c(c1)s/c(=N\C(=O)c1cccc(c1Cl)Cl)/[nH]2

STK628793
Synonyms: 2-[4-(cyclopropylcarbamothioyl)piperazin-1-yl]-N,N-dimethylacetamide
Smiles: CN(C(=O)CN1CCN(CC1)C(=S)NC1CC1)C

STK628795
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[2-(morpholin-4-yl)ethyl]piperidine-1-carbothioamide
Smiles: S=C(N1CCCCC1CCN1CCOCC1)Nc1cc(ccc1Cl)C(F)(F)F

STK628798
Synonyms: 1-{[(4-oxo-3,4-dihydrospiro[chromene-2,1'-cyclohexan]-7-yl)oxy]acetyl}piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)COc1ccc2c(c1)OC1(CC2=O)CCCCC1

STK628799
Synonyms: 6-benzyl-3-[(3-hydroxypropyl)amino]-1,2,4-triazin-5-ol
Smiles: OCCCNc1nnc(c(n1)O)Cc1ccccc1

STK628800
Synonyms: 6-chloro-5-(chloroacetyl)-1,3-dihydro-2H-indol-2-one
Smiles: ClCC(=O)c1cc2CC(=O)Nc2cc1Cl

STK628801
Synonyms: N-(5-carbamoyl-1-methyl-1H-pyrazol-4-yl)-N'-[3-(2-oxopyrrolidin-1-yl)propyl]ethanediamide
Smiles: O=C1CCCN1CCCNC(=O)C(=O)Nc1cnn(c1C(=O)N)C

STK628804
Synonyms: (4E)-5-(4-chlorophenyl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-[3-(1H-imidazol-1-yl)propyl]pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)C1N(CCCn2cncc2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/O

STK628805
Synonyms: 5-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-(ethylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: CCSc1nn2c(n1)nc(cc2O)CSc1nnc(s1)N

STK628806
Synonyms: 8-{3-[(4-bromophenyl)amino]propyl}-4-hydroxy-1,6,7-trimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Brc1ccc(cc1)NCCCn1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK628807
Synonyms: 6-(3-bromo-4-fluorophenyl)-3-[(phenylsulfanyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Fc1ccc(cc1Br)c1nn2c(s1)nnc2CSc1ccccc1

STK628808
Synonyms: N,N'-[4-(thiophen-2-yl)-1,3-thiazol-5-yl-2-ylidene]difuran-2-carboxamide
Smiles: O=C(c1ccco1)Nc1s/c(=N/C(=O)c2ccco2)/[nH]c1c1cccs1

STK628809
Synonyms: methyl4-{[ethyl(phenyl)carbamoyl]amino}butanoate
Smiles: CCN(c1ccccc1)C(=O)NCCCC(=O)OC

STK628810
Synonyms: (2Z)-7-[(dipropylammonio)methyl]-3-oxo-2-(2,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cc(OC)c(cc1OC)OC)/C2=O)CCC

STK628812
Synonyms: 1-(azepan-1-yl)-2-[1-(morpholin-4-ylmethyl)-1H-indol-3-yl]ethanone
Smiles: O=C(N1CCCCCC1)Cc1cn(c2c1cccc2)CN1CCOCC1

STK628814
Synonyms: 2-[4-(3-chlorophenyl)piperazin-1-yl]-8-methyl-4-(pyridin-3-yl)-4,9-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C1=NC(n2c(=N1)[nH]c(C)cc2=O)c1cccnc1

STK628816
Synonyms: (5Z)-5-({1-[4-(dimethylamino)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}methylidene)-4-hydroxy-1,3-thiazol-2(5H)-one
Smiles: O=C1S/C(=C\c2cc(n(c2C)c2ccc(cc2)N(C)C)C)/C(=N1)O

STK628817
Synonyms: (3E)-1-(2-fluorophenyl)-3-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]pyrrolidine-2,5-dione
Smiles: O=C1C/C(=C\c2c(C)nn(c2C)C)/C(=O)N1c1ccccc1F

STK628818
Synonyms: 1-(1-benzylpiperidin-4-yl)-5-imino-4-(4-phenyl-1,3-thiazol-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: OC1=C(c2scc(n2)c2ccccc2)C(=N)N(C1)C1CCN(CC1)Cc1ccccc1

STK628823
Synonyms: 2-[(3-chlorobenzyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole5,5-dioxide
Smiles: COc1ccc(cc1OC)N1C(=NC2C1CS(=O)(=O)C2)SCc1cccc(c1)Cl

STK628825
Synonyms: (4E)-4-[(4-fluorophenyl)(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(4-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1c1noc(c1)C

STK628826
Synonyms: N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-2-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)/N=c/1\sc2c([nH]1)cccc2

STK628827
Synonyms: (5Z)-3-(4-bromophenyl)-6-hydroxy-5-{[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(ccc1c1ccc(o1)/C=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Br)O)[N+](=O)[O-]

STK628829
Synonyms: propyl4-({[(1'-acetyl-4-oxo-3,4-dihydrospiro[chromene-2,4'-piperidin]-7-yl)oxy]acetyl}amino)benzoate
Smiles: CCCOC(=O)c1ccc(cc1)NC(=O)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C

STK628830
Synonyms: methyl4-[({(2E)-2-[(methylsulfonyl)imino]-2,3-dihydro-1,3-benzothiazol-6-yl}carbonyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2

STK628832
Synonyms: 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-imino-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1cc(ccc1OC)c1csc(n1)C1=C(O)CN(C1=N)C1CCS(=O)(=O)C1

STK628833
Synonyms: N-[2-({[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]acetyl}amino)ethyl]pyridine-4-carboxamide
Smiles: COc1cccc(c1)c1scc(n1)CC(=O)NCCNC(=O)c1ccncc1

STK628835
Synonyms: 5-imino-4-(4-phenyl-1,3-thiazol-2-yl)-1-(3,4,5-trimethoxyphenyl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1cc(cc(c1OC)OC)N1CC(=C(C1=N)c1scc(n1)c1ccccc1)O

STK628839
Synonyms: 4-methyl-8-(morpholin-4-ium-4-ylmethyl)-2-oxo-3-phenyl-2H-chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCOCC1)oc(=O)c(c2C)c1ccccc1

STK628843
Synonyms: (4E)-5-(2,3-dimethoxyphenyl)-4-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2C)OC)/O)/C1c1cccc(c1OC)OC

STK628844
Synonyms: dimethylN-{[2-(5-fluoro-1H-indol-3-yl)ethyl]carbamoyl}-L-glutamate
Smiles: COC(=O)[C@@H](NC(=O)NCCc1c[nH]c2c1cc(F)cc2)CCC(=O)OC

STK628846
Synonyms: (5Z)-3-(2-methylpropyl)-5-[(4-phenylpiperazin-1-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CC(CN1C(=S)S/C(=C\N2CCN(CC2)c2ccccc2)/C1=O)C

STK628847
Synonyms: 1-methyl-1-[(5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinolin-6-yl)methyl]-3-[4-(propan-2-yl)phenyl]thiourea
Smiles: S=C(N(Cc1cc2cccc3c2n(c1=O)CCC3)C)Nc1ccc(cc1)C(C)C

STK628848
Synonyms: 2,4-dimethoxy-N-[(4E)-8-methoxy-6-(4-methoxyphenyl)-1,3-dimethyl-4H-cyclohepta[c]furan-4-ylidene]aniline
Smiles: COc1ccc(cc1)c1cc(OC)c2c(/c(=N/c3ccc(cc3OC)OC)/c1)c(oc2C)C

STK628850
Synonyms: N-(2-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1-ethyl-1H-benzimidazol-5-yl)thiophene-2-carboxamide
Smiles: CCn1c(CSc2nc(C)cc(n2)C)nc2c1ccc(c2)NC(=O)c1cccs1

STK628851
Synonyms: (2Z)-2-(1-benzofuran-2-ylmethylidene)-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cc3c(o1)cccc3)/C2=O

STK628852
Synonyms: N-(4-bromophenyl)-2-(8,8-dimethyl-4-oxo-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
Smiles: O=C(Cn1cnc2c(c1=O)sc1c2cc2c(n1)CC(OC2)(C)C)Nc1ccc(cc1)Br

STK628855
Synonyms: (4E)-5-(3-bromophenyl)-4-[(3,4-dimethoxyphenyl)(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1OC)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Br)c1noc(c1)C)/O

STK628857
Synonyms: N-[(2Z)-5-acetyl-4-methyl-1,3-thiazol-2(3H)-ylidene]-3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamide
Smiles: O=C(/N=c/1\sc(c([nH]1)C)C(=O)C)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C

STK628859
Synonyms: 2-[4-(8,9-dimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)piperazin-1-yl]-N-(furan-2-ylmethyl)acetamide
Smiles: O=C(CN1CCN(CC1)c1nc2sc(c(c2c2n1ncn2)C)C)NCc1ccco1

STK628860
Synonyms: N-(2,5-dimethoxyphenyl)-1-(7H-purin-6-yl)piperidine-3-carboxamide
Smiles: COc1ccc(cc1NC(=O)C1CCCN(C1)c1ncnc2c1[nH]cn2)OC

STK628863
Synonyms: 5-(2,4-dichlorophenyl)-6-[3-(diethylamino)propyl]-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: CCN(CCCn1cc2c(c1c1ccc(cc1Cl)Cl)c(=O)n(c(=O)n2C)C)CC

STK628865
Synonyms: 2-[(2-methyl-4-oxo-3-phenyl-4H-chromen-7-yl)oxy]-N-(4-methylpyridin-2-yl)acetamide
Smiles: O=C(Nc1nccc(c1)C)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK628866
Synonyms: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-imino-4-(4-phenyl-1,3-thiazol-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: OC1=C(c2scc(n2)c2ccccc2)C(=N)N(C1)c1ccc2c(c1)OCCO2

STK628867
Synonyms: methyl1-[4-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)butanoyl]piperidine-4-carboxylate
Smiles: COC(=O)C1CCN(CC1)C(=O)CCCn1c(O)nc2c(c1=O)cccc2

STK628870
Synonyms: 8-[3-(4-benzylpiperidin-1-yl)propyl]-4-hydroxy-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Oc1nc(=O)n(c2c1n1cc(n(c1n2)CCCN1CCC(CC1)Cc1ccccc1)C)C

STK628871
Synonyms: (4Z)-4-{[1-(4-fluorobenzyl)-1H-indol-3-yl]methylidene}-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Fc1ccc(cc1)Cn1cc(c2c1cccc2)/C=C\1/C(=NN(C1=O)c1ccccc1)O

STK628872
Synonyms: 6-({[4-(morpholin-4-ylmethyl)phenyl]ammonio}methyl)-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH2+]c1ccc(cc1)CN1CCOCC1)oc(=O)c1c2CCC1

STK628873
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-1-[3-(morpholin-4-yl)propyl]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccccc2)/O)/C(N1CCCN1CCOCC1)c1ccccn1

STK628875
Synonyms: 2-{[2,2-dimethyl-5-(pyrrolidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}-1-phenylethanone
Smiles: O=C(c1ccccc1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCCC1

STK628876
Synonyms: 2-{[3-(3,4-dimethoxyphenyl)-2-oxo-2H-chromen-7-yl]oxy}-N-(pyridin-2-ylmethyl)acetamide
Smiles: COc1cc(ccc1OC)c1cc2ccc(cc2oc1=O)OCC(=O)NCc1ccccn1

STK628879
Synonyms: N-(3-methoxypropyl)-1-(pyrimidin-2-yl)piperidine-4-carboxamide
Smiles: COCCCNC(=O)C1CCN(CC1)c1ncccn1

STK628881
Synonyms: 6-(4-chlorobenzyl)-2-(furan-2-yl)-10,10-dimethyl-6,8,10,11-tetrahydro-5H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-one
Smiles: Clc1ccc(cc1)Cn1c(=O)n2nc(nc2c2c1sc1c2CC(OC1)(C)C)c1ccco1

STK628883
Synonyms: 4'-tert-butyl-7-[2-(4-hydroxypiperidin-1-yl)-2-oxoethoxy]spiro[chromene-2,1'-cyclohexan]-4(3H)-one
Smiles: OC1CCN(CC1)C(=O)COc1ccc2c(c1)O[C@]1(CC2=O)CCC(CC1)C(C)(C)C

STK628886
Synonyms: N-[(1S)-2-hydroxy-1-phenylethyl]-2-[(2-methyl-4-oxo-3-phenoxy-4H-chromen-7-yl)oxy]acetamide
Smiles: OC[C@H](c1ccccc1)NC(=O)COc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C

STK628888
Synonyms: 3-[(5E)-5-(2-fluorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[3-(1H-imidazol-1-yl)propyl]propanamide
Smiles: O=C(CCN1C(=O)S/C(=C/c2ccccc2F)/C1=O)NCCCn1ccnc1

STK628890
Synonyms: N-(3-hydroxyphenyl)-2-{[3-(4-methoxyphenoxy)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetamide
Smiles: COc1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1cccc(c1)O

STK628891
Synonyms: 4-(2-{3-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-hydroxy-2-imino-2,5-dihydro-1H-pyrrol-1-yl}ethyl)benzenesulfonamide
Smiles: COc1ccc(cc1OC)c1csc(n1)C1=C(O)CN(C1=N)CCc1ccc(cc1)S(=O)(=O)N

STK628895
Synonyms: (5E)-5-{[5-(2-chloro-4-nitrophenyl)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)c2ccc(cc2Cl)[N+](=O)[O-])/C1=O)O

STK628896
Synonyms: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-5-imino-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1ccc(cc1OC)c1csc(n1)C1=C(O)CN(C1=N)c1ccc2c(c1)OCCO2

STK628897
Synonyms: 2-hydroxy-1-(4-methoxyphenyl)-6-(pyridin-3-ylmethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)Cc1cccnc1

STK628898
Synonyms: (2Z)-7-(azepanium-1-ylmethyl)-2-(1-benzofuran-2-ylmethylidene)-4-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: Cc1cc([O-])c(c2c1C(=O)/C(=C/c1cc3c(o1)cccc3)/O2)C[NH+]1CCCCCC1

STK628900
Synonyms: (2E)-2-[(1-methyl-1H-indol-3-yl)methylidene]-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK628901
Synonyms: 4-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-2-methyl-N-[2-(thiophen-2-yl)ethyl]benzenesulfonamide
Smiles: O=C1N(c2ccc(c(c2)C)S(=O)(=O)NCCc2cccs2)S(=O)(=O)CC1(C)C

STK628902
Synonyms: 7-(4-chlorophenyl)-9-methyl-3-(3-phenylpropyl)thieno[2,3-d:4,5-d']dipyrimidin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc(C)c2c(n1)sc1c2ncn(c1=O)CCCc1ccccc1

STK628905
Synonyms: 3,7,7-trimethyl-4-(2,3,4-trimethoxyphenyl)-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: COc1ccc(c(c1OC)OC)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)(C)C

STK628906
Synonyms: N-[2-(6-chloro-7-methyl-2-oxo-2H-chromen-4-yl)-1-benzofuran-3-yl]-1,3-benzodioxole-5-carboxamide
Smiles: O=c1oc2cc(C)c(cc2c(c1)c1oc2c(c1NC(=O)c1ccc3c(c1)OCO3)cccc2)Cl

STK628907
Synonyms: 2-[(9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-7-yl)oxy]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
Smiles: O=C(NC1CC(C)(C)NC(C1)(C)C)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK628908
Synonyms: (5E)-3-(4-chlorophenyl)-5-{[1-(3,5-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cc(n(c2C)c2cc(C)cc(c2)C)C)/C1=O)O

STK628910
Synonyms: N-(4-hydroxyphenyl)-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridazine-3-carboxamide
Smiles: Oc1ccc(cc1)NC(=O)C1=NN(C(=O)CC1)c1ccccc1

STK628912
Synonyms: N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(pyrimidin-2-yl)piperidine-4-carboxamide
Smiles: COc1ccc(cc1)c1noc(n1)CNC(=O)C1CCN(CC1)c1ncccn1

STK628913
Synonyms: 2,2-dimethyl-N-(1-methyl-2-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-1H-benzimidazol-5-yl)propanamide
Smiles: Cc1ccnc(n1)SCc1nc2c(n1C)ccc(c2)NC(=O)C(C)(C)C

STK628916
Synonyms: 4-{[2-(4-methoxyphenyl)ethyl]amino}tetrahydrothiophene-3-ol1,1-dioxide
Smiles: COc1ccc(cc1)CCNC1CS(=O)(=O)CC1O

STK628917
Synonyms: N-(4-{(5E)-5-[(2-methyl-2H-chromen-3-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=S)S/C(=C/C2=Cc3ccccc3OC2C)/C1=O

STK628918
Synonyms: 2-[(2,3-dimethoxyphenyl)(4-methylpiperazin-1-yl)methyl]-5-methoxynaphthalen-1-ol
Smiles: COc1c(OC)cccc1C(c1ccc2c(c1O)cccc2OC)N1CCN(CC1)C

STK628919
Synonyms: 4-(pyridin-3-yl)-5-(quinolin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1c1cccnc1)c1ccc2c(n1)cccc2

STK628922
Synonyms: 5-ethyl-8-oxo-N-(4-sulfamoylbenzyl)-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: CCn1cc(C(=O)NCc2ccc(cc2)S(=O)(=O)N)c(=O)c2c1cc1OCOc1c2

STK628924
Synonyms: N~3~-(2-chloro-7H-purin-6-yl)-N-pyridin-3-yl-beta-alaninamide
Smiles: O=C(Nc1cccnc1)CCNc1nc(Cl)nc2c1[nH]cn2

STK628925
Synonyms: 3-(3,4-dimethoxyphenyl)-8-(morpholin-4-ium-4-ylmethyl)-2-oxo-2H-chromen-7-olate
Smiles: COc1cc(ccc1OC)c1cc2ccc(c(c2oc1=O)C[NH+]1CCOCC1)[O-]

STK628930
Synonyms: N-(5-chloropyridin-2-yl)-2-[(2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(Nc1ccc(cn1)Cl)COc1ccc2c(c1)oc(=O)cc2

STK628932
Synonyms: (2Z)-2-[(methylsulfonyl)imino]-N-[2-(4-sulfamoylphenyl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-carboxamide
Smiles: O=C(c1ccc2c(c1)s/c(=N\S(=O)(=O)C)/[nH]2)NCCc1ccc(cc1)S(=O)(=O)N

STK628934
Synonyms: (5E)-1-(4-chlorophenyl)-5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C\c2cc(n(c2C)c2cccc(c2)[N+](=O)[O-])C)/C1=O)S

STK628935
Synonyms: 6-(3-butyl-1H-pyrazol-5-yl)-3-(pyrazin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: CCCCc1n[nH]c(c1)c1nn2c(s1)nnc2c1cnccn1

STK628936
Synonyms: N-cyclohexyl-3-[(4S)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]propanamide
Smiles: O=C(NC1CCCCC1)CC[C@@H]1NC(=O)N(C1=O)Cc1ccco1

STK628937
Synonyms: N-[(2Z)-6-{[(3,4-dimethoxyphenyl)carbonyl]amino}-1,3-benzothiazol-2(3H)-ylidene]furan-2-carboxamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1ccc2c(c1)s/c(=N\C(=O)c1ccco1)/[nH]2

STK628938
Synonyms: (2Z)-2-(2-bromobenzylidene)-7-[(dipropylammonio)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccccc1Br)/C2=O)CCC

STK628943
Synonyms: (2E)-2-{[(4-chlorophenyl)sulfonyl]imino}-N-[1-hydroxy-4-(methylsulfanyl)butan-2-yl]-2,3-dihydro-1,3-benzothiazole-6-carboxamide
Smiles: CSCCC(NC(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)c1ccc(cc1)Cl)/[nH]2)CO

STK628946
Synonyms: 1-(2-chloro-7H-purin-6-yl)-N-(3-methylbutyl)piperidine-3-carboxamide
Smiles: CC(CCNC(=O)C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)C

STK628948
Synonyms: trans-4-({[(4-chlorophenyl)sulfonyl]amino}methyl)-N-{(2S)-1-oxo-1-[(pyridin-3-ylmethyl)amino]propan-2-yl}cyclohexanecarboxamide
Smiles: O=C([C@@H](NC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)Cl)C)NCc1cccnc1

STK628954
Synonyms: N~6~-(3,5-dimethoxyphenyl)-7H-purine-2,6-diamine
Smiles: COc1cc(cc(c1)OC)Nc1nc(N)nc2c1[nH]cn2

STK628955
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-4H-chromen-7-yl]oxy}-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide
Smiles: O=C(NC1CCS(=O)(=O)C1)COc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK628956
Synonyms: (2E)-7-[(dibutylammonio)methyl]-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C/c1cn(c3c1cc(OC)cc3)CC)/C2=O)CCCC

STK628957
Synonyms: N-(4-{(5E)-5-[(8-methoxyquinolin-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}phenyl)acetamide
Smiles: COc1cccc2c1nc(cc2)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)NC(=O)C

STK628958
Synonyms: 1-(1H-indol-2-ylcarbonyl)-N-(1-phenylethyl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)c1cc2c([nH]1)cccc2)NC(c1ccccc1)C

STK628960
Synonyms: N-[(2E)-2-{[(2E)-3-phenylprop-2-enoyl]imino}-4-(thiophen-2-yl)-2,3-dihydro-1,3-thiazol-5-yl]furan-2-carboxamide
Smiles: O=C(/N=c\1/sc(c([nH]1)c1cccs1)NC(=O)c1ccco1)/C=C/c1ccccc1

STK628961
Synonyms: 2-(4-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}-3-methylphenyl)-4,4-dimethyl-1,2-thiazolidin-3-one1,1-dioxide
Smiles: O=C1N(c2ccc(c(c2)C)S(=O)(=O)N2CCN(CC2)c2ccccc2F)S(=O)(=O)CC1(C)C

STK628966
Synonyms: 1-benzyl-5-imino-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)Cc1ccccc1

STK628967
Synonyms: 2-(4-benzylpiperazin-1-yl)-3,6,6-trimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Cn1c(nc2c(c1=O)c1CC(C)(C)OCc1s2)N1CCN(CC1)Cc1ccccc1

STK628968
Synonyms: (5E)-3-(2-fluorophenyl)-5-[(6-hydroxy[1,3]dioxolo[4,5-g]quinolin-7-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2cc3cc4OCOc4cc3nc2O)/C(=O)N1c1ccccc1F

STK628971
Synonyms: N-benzyl-2-{4-[4-cyano-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]piperazin-1-yl}-2-oxoacetamide
Smiles: N#Cc1c(nc(c2c1CCCC2)C(C)C)N1CCN(CC1)C(=O)C(=O)NCc1ccccc1

STK628972
Synonyms: N-benzyl-1-(2-methylprop-2-en-1-yl)cyclohexanamine
Smiles: CC(=C)CC1(NCc2ccccc2)CCCCC1

STK628973
Synonyms: N-(2,4-dimethoxyphenyl)-2-(7H-purin-6-ylsulfanyl)propanamide
Smiles: COc1cc(OC)ccc1NC(=O)C(Sc1ncnc2c1[nH]cn2)C

STK628974
Synonyms: 2-{[3-(2-ethoxyphenoxy)-4-oxo-4H-chromen-7-yl]oxy}-N-(pyridin-2-yl)acetamide
Smiles: CCOc1ccccc1Oc1coc2c(c1=O)ccc(c2)OCC(=O)Nc1ccccn1

STK628975
Synonyms: 2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[3-(dimethylamino)propyl]acetamide
Smiles: CN(CCCNC(=O)CN1C(=O)S/C(=C/c2ccc3c(c2)OCO3)/C1=O)C

STK628977
Synonyms: (2Z)-6-{2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethoxy}-2-(thiophen-2-ylmethylidene)-1-benzofuran-3(2H)-one
Smiles: OC[C@@H]1CCCN1C(=O)COc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O

STK628981
Synonyms: 5-amino-N-(4-fluorophenyl)-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Smiles: CSc1cccc(c1)n1nnc(c1N)C(=O)Nc1ccc(cc1)F

STK628983
Synonyms: 1-(3-hydroxypropyl)-3,9-dimethyl-7-(3-methylbutyl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: OCCCN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STK628984
Synonyms: [4-amino-3-(1,3-benzodioxol-5-ylmethyl)-2-thioxo-2,3-dihydro-1,3-thiazol-5-yl](morpholin-4-yl)methanone
Smiles: O=C(c1sc(=S)n(c1N)Cc1ccc2c(c1)OCO2)N1CCOCC1

STK628985
Synonyms: 1-(2-chloro-7H-purin-6-yl)-N-[2-(1H-indol-3-yl)ethyl]piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)NCCc1c[nH]c2c1cccc2

STK628986
Synonyms: (4E)-5-(3-chlorophenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(1H-imidazol-1-yl)propyl]pyrrolidine-2,3-dione
Smiles: Clc1cccc(c1)C1N(CCCn2cncc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK628989
Synonyms: 3-(2-bromophenoxy)-2-methyl-7-[2-oxo-2-(thiomorpholin-4-yl)ethoxy]-4H-chromen-4-one
Smiles: O=C(N1CCSCC1)COc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1Br)C

STK628994
Synonyms: 2-[(1'-acetyl-4-oxo-3,4-dihydrospiro[chromene-2,4'-piperidin]-7-yl)oxy]-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C

STK628995
Synonyms: 4-(5-chloro-2-methoxyphenyl)-5-(quinoxalin-6-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1n1c(=S)[nH]nc1c1ccc2c(c1)nccn2)Cl

STK628996
Synonyms: N-[2-(dimethylamino)ethyl]-N'-{2-[(pyridin-3-ylmethyl)carbamoyl]phenyl}ethanediamide
Smiles: CN(CCNC(=O)C(=O)Nc1ccccc1C(=O)NCc1cccnc1)C

STK628999
Synonyms: 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-5-imino-1-(thiophen-2-ylmethyl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1cc(ccc1OC)c1csc(n1)C1=C(O)CN(C1=N)Cc1cccs1

STK629001
Synonyms: 4-amino-3-[3-(morpholin-4-yl)propyl]-2-thioxo-2,3-dihydro-1,3-thiazole-5-carboxamide
Smiles: NC(=O)c1sc(=S)n(c1N)CCCN1CCOCC1

STK629002
Synonyms: 4-(1,3-benzoxazol-2-yl)-N-(2-chlorophenyl)piperidine-1-carbothioamide
Smiles: S=C(N1CCC(CC1)c1nc2c(o1)cccc2)Nc1ccccc1Cl

STK629003
Synonyms: (2Z)-7-{[bis(2-methylpropyl)ammonio]methyl}-2-(2-ethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCOc1ccccc1/C=C/1\Oc2c(C1=O)ccc(c2C[NH+](CC(C)C)CC(C)C)[O-]

STK629004
Synonyms: 2-[(4-fluorobenzyl)sulfanyl]-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1c(SCc2ccc(cc2)F)nc2c(c1C(F)(F)F)CCCC2

STK629007
Synonyms: N~2~-(2-chloro-7H-purin-6-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)glycinamide
Smiles: O=C(NC1CC(C)(C)NC(C1)(C)C)CNc1nc(Cl)nc2c1[nH]cn2

STK629010
Synonyms: N-benzyl-2-[(2-chloro-7H-purin-6-yl)sulfanyl]acetamide
Smiles: O=C(NCc1ccccc1)CSc1nc(Cl)nc2c1[nH]cn2

STK629011
Synonyms: 3,9-dicyclopentyl-12-(2-methoxyphenyl)-6-thioxo-3,4,9,10-tetrahydro-2H-7,11-methano[1,3,5]triazino[1,2-a][1,5]diazocine-7,11(6H,8H)-dicarbonitrile
Smiles: COc1ccccc1C1C2(C#N)CN(CC1(C#N)C1=NCN(CN1C2=S)C1CCCC1)C1CCCC1

STK629016
Synonyms: ethyl4-(2,4-dimethoxyphenyl)-2-hydroxy-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: CCOC(=O)C1C(=Nc2n(C1c1ccc(cc1OC)OC)c1ccccc1n2)O

STK629017
Synonyms: 8-{[(1-benzylpiperidin-4-yl)ammonio]methyl}-6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-chromen-7-olate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2C[NH2+]C1CCN(CC1)Cc1ccccc1)[O-])Cl

STK629019
Synonyms: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl](4-chlorophenyl)methanethione
Smiles: Clc1ccc(cc1)C(=S)N1CCN(CC1)c1nsc2c1cccc2

STK629020
Synonyms: 7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one
Smiles: O=C(N1CCN(CC1)c1ccccc1)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK629021
Synonyms: N-[2-(4-hydroxyphenyl)ethyl]-N'-{2-[(3-methoxypropyl)carbamoyl]phenyl}ethanediamide
Smiles: COCCCNC(=O)c1ccccc1NC(=O)C(=O)NCCc1ccc(cc1)O

STK629022
Synonyms: methyl2-({[2-methoxy-5-(4-methyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)phenyl]sulfonyl}amino)benzoate
Smiles: COC(=O)c1ccccc1NS(=O)(=O)c1cc(ccc1OC)N1C(=O)C(CS1(=O)=O)C

STK629023
Synonyms: 5-amino-1-(4-bromophenyl)-N-(2-phenylpropyl)-1H-1,2,3-triazole-4-carboxamide
Smiles: Brc1ccc(cc1)n1nnc(c1N)C(=O)NCC(c1ccccc1)C

STK629024
Synonyms: 6-(2-{4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl}-2-oxoethyl)-2,3,5-trimethyl-7H-furo[3,2-g]chromen-7-one
Smiles: O=C(N1CCN(CC1)CC(=O)N1CCCCCC1)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C

STK629026
Synonyms: 1-[(4-chlorophenyl)sulfonyl]-N-{2-[(2-hydroxypropyl)amino]-2-oxoethyl}piperidine-3-carboxamide
Smiles: CC(CNC(=O)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)Cl)O

STK629027
Synonyms: methylN-[(4-methylpiperidin-1-yl)carbonyl]-beta-alaninate
Smiles: COC(=O)CCNC(=O)N1CCC(CC1)C

STK629030
Synonyms: (2Z)-2-(2-chlorobenzylidene)-8-[2-(morpholin-4-yl)ethyl]-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
Smiles: O=C1/C(=C/c2ccccc2Cl)/Oc2c1ccc1c2CN(CO1)CCN1CCOCC1

STK629033
Synonyms: 7-hexadecyl-2-hydroxy-3-methyl-8-(methylamino)-3,7-dihydro-6H-purin-6-one
Smiles: CCCCCCCCCCCCCCCCn1c(NC)nc2c1c(=O)nc(n2C)O

STK629036
Synonyms: 1-(7H-purin-6-yl)-N-(3,4,5-trimethoxyphenyl)piperidine-3-carboxamide
Smiles: COc1cc(NC(=O)C2CCCN(C2)c2ncnc3c2[nH]cn3)cc(c1OC)OC

STK629037
Synonyms: 2-[(2,2-dimethyl-6-oxo-3,4,6,7,8,9-hexahydro-2H-cyclopenta[c]pyrano[2,3-h]chromen-10-yl)oxy]-N-(4-hydroxy-1,1-dioxidotetrahydrothiophen-3-yl)acetamide
Smiles: O=C(NC1CS(=O)(=O)CC1O)COc1cc2OC(C)(C)CCc2c2c1c1CCCc1c(=O)o2

STK629038
Synonyms: (4E)-4-{[4-(benzyloxy)-2-methylphenyl](hydroxy)methylidene}-5-(4-methylphenyl)-1-[3-(morpholin-4-yl)propyl]pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)C1N(CCCN2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OCc1ccccc1)/O

STK629039
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(dimethylamino)propyl]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CN(CCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1cccc(c1)[N+](=O)[O-])C

STK629040
Synonyms: 7-(5-bromopyridin-2-yl)-5,6-dimethyl-N-(pyridin-4-ylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: Brc1ccc(nc1)n1c(C)c(c2c1ncnc2NCc1ccncc1)C

STK629042
Synonyms: 6-chloro-8-{[(2-methoxyethyl)ammonio]methyl}-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-chromen-7-olate
Smiles: COCC[NH2+]Cc1c([O-])c(Cl)cc2c1oc(=O)c(c2C)CC(=O)OC

STK629045
Synonyms: 4-{2-[(3-fluorobenzyl)oxy]-3-methoxyphenyl}-1-(4-methoxyphenyl)-3-methyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: COc1cccc(c1OCc1cccc(c1)F)C1CC(=Nc2c1c(C)nn2c1ccc(cc1)OC)O

STK629046
Synonyms: 4-methyl-2-phenyl-N-(pyridin-3-yl)-1,3-thiazole-5-carboxamide
Smiles: Cc1nc(sc1C(=O)Nc1cccnc1)c1ccccc1

STK629048
Synonyms: 2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(pyridin-2-yl)acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1ccccn1

STK629050
Synonyms: 4-[(10aS)-7,8-dimethoxy-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-[3-(dimethylamino)propyl]butanamide
Smiles: COc1cc2CN3C(=O)N(C(=O)[C@@H]3Cc2cc1OC)CCCC(=O)NCCCN(C)C

STK629053
Synonyms: (5E)-3-(4-chlorophenyl)-6-hydroxy-5-({[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C\NCCc2onc(n2)c2ccccc2)/C1=O)O

STK629054
Synonyms: (4E)-4-(4-{2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy}-3-ethoxybenzylidene)-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCOc1cc(ccc1OCCOCCOc1ccc(c(c1)C)C)/C=C/1\C(=NN(C1=O)c1ccccc1)O

STK629055
Synonyms: 8-(benzylsulfanyl)-2,2-dimethyl-5-(pyrrolidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(nc2N2CCCC2)sc2c1ncnc2SCc1ccccc1

STK629056
Synonyms: (4E)-5-(3-chlorophenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)c1noc(c1)C)/O

STK629057
Synonyms: 5-chloro-N-[4-(3-ethyl-2-hydroxy-6-oxo-3,4,5,6-tetrahydropyridin-3-yl)phenyl]-1-benzofuran-2-carboxamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NC(=O)c1cc2c(o1)ccc(c2)Cl

STK629060
Synonyms: 6-{3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dimethyl-7H-furo[3,2-g]chromen-7-one
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C

STK629063
Synonyms: methylN-[(1-cyclopropyl-6,7-difluoro-8-methoxy-4-oxo-1,4-dihydroquinolin-3-yl)carbonyl]glycinate
Smiles: COC(=O)CNC(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2OC)F)F

STK629067
Synonyms: 2-(4-benzylpiperidin-1-yl)-4-(2-methoxyphenyl)-8-methyl-4H-pyrimido[1,2-a][1,3,5]triazin-6-ol
Smiles: COc1ccccc1C1N=C(N=c2n1c(O)cc(n2)C)N1CCC(CC1)Cc1ccccc1

STK629069
Synonyms: 5-imino-4-(4-methyl-1,3-thiazol-2-yl)-1-(thiophen-2-ylmethyl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)Cc1cccs1

STK629072
Synonyms: {2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethoxy]phenyl}phosphonicacid
Smiles: CC1CCCC(N1C(=O)COc1ccccc1P(=O)(O)O)C

STK629073
Synonyms: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(furan-2-yl)-1,3-oxazol-5-yl]piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)c1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccco1

STK629075
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(dimethylamino)propyl]-5-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: C=CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCCN(C)C

STK629079
Synonyms: N-[3-(dimethylamino)propyl]-3-phenyl-2,1-benzoxazole-5-carboxamide
Smiles: CN(CCCNC(=O)c1ccc2c(c1)c(on2)c1ccccc1)C

STK629080
Synonyms: 7-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethoxy]-3-(4-methoxyphenyl)-4H-chromen-4-one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCC(=O)N1CC(C)OC(C1)C

STK629081
Synonyms: 6'-hydroxy-3'-methyl-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: O=C1N=C(O)C2(C(=O)N1C)Cc1cc(ccc1N1C2COCC1)[N+](=O)[O-]

STK629085
Synonyms: 2-{4-[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1CCN(CC1)C(=O)C1COc2c(O1)cccc2)CCCN1C(=O)c2c(C1=O)cccc2

STK629086
Synonyms: 4-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)Nc2cccc(c2)C(F)(F)F)S(=O)(=O)CC1(C)C

STK629087
Synonyms: 6-(3-{4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl}-3-oxopropyl)-3,5-dimethyl-7H-furo[3,2-g]chromen-7-one
Smiles: O=C(N1CCN(CC1)CC(=O)N1CCCCCC1)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C

STK629088
Synonyms: 1-(4-bromobenzyl)-4-imino-6,6-dimethyl-1,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2-thiol
Smiles: Brc1ccc(cc1)Cn1c(S)nc(=N)c2c1sc1c2CC(OC1)(C)C

STK629100
Synonyms: (2E)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C/c1cn(c3c1cc(OC)cc3)C)/C2=O

STK629101
Synonyms: 4,7-bis(4-hydroxyphenyl)-3-methyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: Oc1ccc(cc1)C1CC(=C2C(=Nc3c(C2c2ccc(cc2)O)c(no3)C)C1)O

STK629103
Synonyms: 1-(2-chloro-7H-purin-6-yl)-N-[2-(morpholin-4-yl)ethyl]piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2)NCCN1CCOCC1

STK629105
Synonyms: (4E)-5-(4-bromophenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)Br)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)/O

STK629112
Synonyms: (5E)-1-(4-methoxyphenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(o2)c2ccccc2[N+](=O)[O-])/C1=O)S

STK629113
Synonyms: (5E)-5-{[1-(3,5-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(3-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cccc(c1)N1C(=NC(=O)/C(=C\c2cc(n(c2C)c2cc(C)cc(c2)C)C)/C1=O)S

STK629114
Synonyms: N-(1H-indol-5-yl)-N'-(2-phenylethyl)ethanediamide
Smiles: O=C(C(=O)NCCc1ccccc1)Nc1ccc2c(c1)cc[nH]2

STK629115
Synonyms: 4-[(10aS)-7,8-dimethoxy-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(2,2-dimethoxyethyl)butanamide
Smiles: COC(CNC(=O)CCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cc(c(c1)OC)OC)OC

STK629116
Synonyms: 2-[(8-ethoxy-4-methylquinazolin-2-yl)amino]-6-methyl-5-(3-methylbenzyl)pyrimidin-4-ol
Smiles: CCOc1cccc2c1nc(Nc1nc(C)c(c(n1)O)Cc1cccc(c1)C)nc2C

STK629118
Synonyms: N~2~-(2-chloro-7H-purin-6-yl)-N-[2-(morpholin-4-yl)ethyl]glycinamide
Smiles: O=C(CNc1nc(Cl)nc2c1[nH]cn2)NCCN1CCOCC1

STK629119
Synonyms: 9-(furan-2-ylmethyl)-3-(2-methoxyphenyl)-2-methyl-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-one
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc1c2CN(CO1)Cc1ccco1

STK629121
Synonyms: N-[1-(2-chlorophenyl)-4-hydroxy-2,6-dioxo-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)NC1(C(=O)Nc2c1c(O)nc(=O)n2c1ccccc1Cl)C(F)(F)F

STK629123
Synonyms: (5E)-3-(1,3-benzodioxol-5-yl)-5-[(2,7-diethoxynaphthalen-1-yl)methylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccc2c(c1/C=C/1\C(=NC(=O)N(C1=O)c1ccc3c(c1)OCO3)O)cc(cc2)OCC

STK629125
Synonyms: 1-cyclopropyl-6,7-difluoro-N-(2-hydroxy-5-methylphenyl)-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)Nc1cc(C)ccc1O)C1CC1

STK629126
Synonyms: 3-(2-chlorophenyl)-5-(2,4-difluorophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: Fc1ccc(c(c1)F)N1C(=O)C2C(C1=O)C(=NO2)c1ccccc1Cl

STK629127
Synonyms: 2-{[3-(2-ethoxyphenoxy)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}-N-(2-hydroxy-5-methylphenyl)acetamide
Smiles: CCOc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1cc(C)ccc1O

STK629133
Synonyms: 2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxo-N-(pyridin-4-yl)acetamide
Smiles: OCCC1CCCCN1C(=O)C(=O)Nc1ccncc1

STK629134
Synonyms: N-(3-hydroxypropyl)-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide
Smiles: OCCCNC(=O)C1CCCN(C1)c1ccc(cn1)[N+](=O)[O-]

STK629136
Synonyms: methyl4-methyl-5-[(morpholin-4-ylcarbonyl)amino]-2-phenylthieno[2,3-d]pyrimidine-6-carboxylate
Smiles: COC(=O)c1sc2c(c1NC(=O)N1CCOCC1)c(C)nc(n2)c1ccccc1

STK629137
Synonyms: (4Z)-2-(furan-2-yl)-4-{6-methoxy-2-[4-(methylsulfanyl)phenyl]-4H-chromen-4-ylidene}-1,3-oxazol-5(4H)-one
Smiles: COc1ccc2c(c1)/C(=C/1\N=C(OC1=O)c1ccco1)/C=C(O2)c1ccc(cc1)SC

STK629140
Synonyms: N-{1-[(3-chlorobenzyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl}-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: CSCCC(C(=O)NCc1cccc(c1)Cl)NC(=O)N1CC(=Nc2c1cccc2)O

STK629144
Synonyms: 5-imino-1-(4-methoxyphenyl)-4-(4-methyl-1,3-thiazol-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1ccc(cc1)N1CC(=C(C1=N)c1scc(n1)C)O

STK629150
Synonyms: 1-(4-methylpiperazin-1-yl)-2-{1-[(4-methylpiperazin-1-yl)methyl]-1H-indol-3-yl}ethanone
Smiles: CN1CCN(CC1)Cn1cc(c2c1cccc2)CC(=O)N1CCN(CC1)C

STK629151
Synonyms: 2-chloro-6-[4-(pyridin-2-yl)piperazin-1-yl]-7H-purine
Smiles: Clc1nc2nc[nH]c2c(n1)N1CCN(CC1)c1ccccn1

STK629152
Synonyms: 2,2'-[(5-chloro-3,6-difluoropyridine-2,4-diyl)disulfonyl]diethanol
Smiles: OCCS(=O)(=O)c1nc(F)c(c(c1F)S(=O)(=O)CCO)Cl

STK629155
Synonyms: N-benzyl-2-{4-[4-cyano-1-(furan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]piperazin-1-yl}-2-oxoacetamide
Smiles: N#Cc1c(nc(c2c1CCCC2)c1ccco1)N1CCN(CC1)C(=O)C(=O)NCc1ccccc1

STK629157
Synonyms: 2-(1-{2-[2-(propan-2-yloxy)phenoxy]ethyl}piperidin-4-yl)-1,3-benzothiazole
Smiles: CC(Oc1ccccc1OCCN1CCC(CC1)c1nc2c(s1)cccc2)C

STK629159
Synonyms: 5-imino-1-[2-(4-methoxyphenyl)ethyl]-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1ccc(cc1)CCN1CC(=C(C1=N)c1scc(n1)c1ccc(cc1)OC)O

STK629160
Synonyms: 1-cyclopropyl-N-[2-(3,4-dihydroxyphenyl)ethyl]-6,7-difluoro-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)NCCc1ccc(c(c1)O)O)C1CC1

STK629163
Synonyms: (2E)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-2-[(1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK629164
Synonyms: 5-imino-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)C(C)C

STK629165
Synonyms: 1-(1-benzylpiperidin-4-yl)-5-imino-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)C1CCN(CC1)Cc1ccccc1

STK629166
Synonyms: 2-[4-(3-methylbutoxy)phenyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-ol
Smiles: CC(CCOc1ccc(cc1)c1nn2c(n1)c1c(nc2O)sc2c1CCC2)C

STK629167
Synonyms: 4-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-2-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide
Smiles: O=C1N(c2ccc(c(c2)C)S(=O)(=O)NCc2cccnc2)S(=O)(=O)CC1(C)C

STK629168
Synonyms: (4E)-5-(4-chlorophenyl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)C1N(Cc2cccnc2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/O

STK629169
Synonyms: 3,10'-dimethyl-6'-propyl-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromene]-4',8'(3'H)-dione
Smiles: CCCc1cc(=O)oc2c1cc1C(=O)CC3(Oc1c2C)CCCC(C3)C

STK629170
Synonyms: (4E)-5-(2,5-dimethoxyphenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2cc(OC)ccc2OC)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)/O

STK629174
Synonyms: 2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-hexylacetamide
Smiles: CCCCCCNC(=O)C(c1nc2ccccc2nc1N1CCCCCC1)C#N

STK629176
Synonyms: 2'-amino-5-chloro-1-methyl-2,5'-dioxo-1,2-dihydro-5'H-spiro[indole-3,4'-pyrano[3,2-c]chromene]-3'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31c1cc(Cl)ccc1N(C3=O)C)c(=O)oc1c2cccc1

STK629177
Synonyms: (2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-7-[(4-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CC1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK629179
Synonyms: N-(3,4-dimethoxybenzyl)-2-methoxy-5-(4-methyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)NCc1ccc(c(c1)OC)OC)N1C(=O)C(CS1(=O)=O)C

STK629180
Synonyms: (4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-[3-(1H-imidazol-1-yl)propyl]-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)C1N(CCCn2cncc2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/O

STK629183
Synonyms: 1-(2-hydroxypropyl)-7,7-dimethyl-2-phenyl-1,5,7,8-tetrahydro-4H-pyrano[4,3-d]pyrimidine-4-thione
Smiles: CC(Cn1c(nc(=S)c2c1CC(C)(C)OC2)c1ccccc1)O

STK629185
Synonyms: (5E)-5-[(5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylidene]-3-[3-(morpholin-4-yl)propyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc2c(c1)c(/C=C\1/SC(=S)N(C1=O)CCCN1CCOCC1)c(n2C)C

STK629187
Synonyms: 7-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethoxy}-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one
Smiles: O=C(N1CCN(CC1)c1cccc(c1C)C)COc1cc(O)c2c(c1)OC(CC2=O)(C)C