Chemical compounds for High-Throughput screening and
Building Blocks for Combinatorial chemistry

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STK574120
Synonyms: N- (2- methylphenyl)- 1- (4- methylphenyl)- 4- oxo- 2- [(1E)- 1- phenylprop- 1- en- 2- yl]azetidine- 2- carboxamide
Smiles: Cc1ccc(cc1)N1C(=O)CC1(C(=O)Nc1ccccc1C)/C(=C/c1ccccc1)/C

STK848181
Synonyms: 2- phenyl- 6,7- dihydro- 5H- cyclopenta[d]pyrazolo[1,5- a]pyrimidin- 8- ol
Smiles: Oc1c2CCCc2nc2n1nc(c2)c1ccccc1

STK574123
Synonyms: N- [(5- chloro- 2- methylphenyl)carbamoyl]- D- alanine
Smiles: O=C(Nc1cc(Cl)ccc1C)N[C@@H](C(=O)O)C

STK574124
Synonyms: (5Z)- 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 5- [(2E)- 3- (2- methoxyphenyl)prop- 2- en- 1- ylidene]- 4- methyl- 2,6- dioxo- 1,2,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CC1=C(C)/C(=C/C=C/c2ccccc2OC)/C(=O)N(C1=O)C1CCS(=O)(=O)C1

STK574126
Synonyms: 4- [(4Z)- 4- (3,4- dimethoxybenzylidene)- 2- methyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl]benzoicacid
Smiles: COc1ccc(cc1OC)/C=C/1\N=C(N(C1=O)c1ccc(cc1)C(=O)O)C

STK574129
Synonyms: 8,10- dimethyl- 4- [4- (6- methylpyridin- 2- yl)piperazin- 1- yl]- 2- propylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidine
Smiles: CCCc1cc(N2CCN(CC2)c2cccc(n2)C)n2c(n1)c1c(C)cc(nc1n2)C

STK574135
Synonyms: 9- (3- ethoxy- 4- hydroxyphenyl)- 2- (ethylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCOc1cc(ccc1O)C1C2=C(O)CCCC2=Nc2n1nc(n2)SCC

STK848182
Synonyms: 2- (2,4- dichlorophenyl)- 8- methoxy- 3- (2- methoxyethyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(o2)cc(cc1)OC)c1ccc(cc1Cl)Cl

STK574138
Synonyms: ethyl1- [(4,5,6- trimethoxy- 1H- indol- 2- yl)carbonyl]piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)C(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC

STK574142
Synonyms: N- [(E)- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methylidene]- 3- (morpholin- 4- yl)quinoxalin- 2- amine
Smiles: COc1cc2CN(/C=N/c3nc4ccccc4nc3N3CCOCC3)CCc2cc1OC

STK848183
Synonyms: 4- {[(1E,2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]amino}- 5- (4- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccc(cc1)c1n[nH]c(=S)n1/N=C/C=C/c1ccco1

STK574148
Synonyms: (1Z)- 6,7- dimethoxy- 1- [(5,6,7,8- tetrahydronaphthalen- 2- ylsulfonyl)methylidene]- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2CCN/C(=C\S(=O)(=O)c3ccc4c(c3)CCCC4)/c2cc1OC

STK574149
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (3- ethoxy- 4- hydroxyphenyl)- 5- (2- methoxyethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COCCN1C(=O)c2c(C1c1ccc(c(c1)OCC)O)c([nH]n2)c1cc(Cl)c(cc1O)C

STK574151
Synonyms: N- [5- hydroxy- 2- (2- phenylethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 2,2- dimethylpropanamide
Smiles: Oc1cc(NC(=O)C(C)(C)C)n2c(n1)nc(n2)CCc1ccccc1

STK574153
Synonyms: (2E)- 3- (4- fluorophenyl)- 1- (5- methylidene- 7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 6(5H)- yl)prop- 2- en- 1- one
Smiles: Fc1ccc(cc1)/C=C/C(=O)N1CCc2c(C1=C)cc1c(c2)OCO1

STK574157
Synonyms: 2- [(2E)- 1,3- benzoxazol- 2(3H)- ylideneamino]- N'- [(4- chlorophenoxy)acetyl]- 4- methylpyrimidine- 5- carbohydrazide
Smiles: O=C(NNC(=O)c1cnc(nc1C)/N=c\1/oc2c([nH]1)cccc2)COc1ccc(cc1)Cl

STK574158
Synonyms: 5- (2- hydroxy- 3,4- dimethylphenyl)- N- [3- (trifluoromethyl)phenyl]- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1O)C)C)Nc1cccc(c1)C(F)(F)F

STK574159
Synonyms: 1- (3,5- dimethoxyphenyl)- 3- (1- methyl- 1H- benzimidazol- 2- yl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: COc1cc(OC)cc(c1)n1c(N)c(c2c1nc1ccccc1n2)c1nc2c(n1C)cccc2

STK574160
Synonyms: 6- ethyl- 10- methyl- 3- (tetrahydrofuran- 2- ylmethyl)- 3,4- dihydro- 2H,8H- chromeno[6,7- e][1,3]oxazin- 8- one
Smiles: CCc1cc(=O)oc2c1cc1CN(COc1c2C)CC1CCCO1

STK574161
Synonyms: 1- benzyl- N- [3- (morpholin- 4- yl)propyl]- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: O=c1c2cc(n(c2nc2n1cccc2)Cc1ccccc1)C(=O)NCCCN1CCOCC1

STK574163
Synonyms: 3- (4- bromophenyl)- 5- (4- chlorophenyl)- 4,5- dihydro- 1,2- oxazole
Smiles: Clc1ccc(cc1)C1ON=C(C1)c1ccc(cc1)Br

STK574166
Synonyms: tert- butyl{(1S)- 1- [5- (methylsulfonyl)- 1,3,4- oxadiazol- 2- yl]- 2- phenylethyl}carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)S(=O)(=O)C)Cc1ccccc1

STK574167
Synonyms: 4- (5- fluoro- 2- methyl- 1H- indol- 3- yl)- 1,3- thiazol- 2- amine
Smiles: Fc1ccc2c(c1)c(c1csc(n1)N)c([nH]2)C

STK574171
Synonyms: N- [(3- amino- 5,6,7,8- tetrahydrothieno[2,3- b]quinolin- 2- yl)carbonyl]glycine
Smiles: OC(=O)CNC(=O)c1sc2c(c1N)cc1c(n2)CCCC1

STK574178
Synonyms: tert- butyl(3S)- 3- ({(2S)- 1- oxo- 1- [(1- phenylethyl)amino]propan- 2- yl}carbamoyl)- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: O=C([C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C)NC(c1ccccc1)C

STK848186
Synonyms: 8- (3,5- dimethylphenyl)- 3- (2- methoxyethyl)- 1,7- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1cc(C)cc(c1)C)C

STK574182
Synonyms: 2- ethyl- N- [(2E)- 3- [2- (4- fluorophenyl)ethyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]butanamide
Smiles: CCC(C(=O)/N=C\1/SC2C(N1CCc1ccc(cc1)F)CS(=O)(=O)C2)CC

STK574185
Synonyms: 2- (phenoxymethyl)- 3,5,6,7- tetrahydro- 8H- cyclopenta[d][1,2,4]triazolo[1,5- a]pyrimidin- 8- one
Smiles: O=c1c2CCCc2nc2n1nc([nH]2)COc1ccccc1

STK574191
Synonyms: 1- (4- tert- butylphenyl)- 5,7- dimethyl- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1cc(C)c2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)C(C)(C)C)Cc1cccnc1

STK574195
Synonyms: N- [(5- chloro- 2- methylphenyl)carbamoyl]- L- methionine
Smiles: Cc1ccc(cc1NC(=O)N[C@H](C(=O)O)CCSC)Cl

STK574199
Synonyms: 5,6- di(furan- 2- yl)- N- (6- methylpyridin- 2- yl)furo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1cccc(n1)Nc1ncnc2c1c(c1ccco1)c(o2)c1ccco1

STK574200
Synonyms: 3- ({4- [(E)- (5- hydroxy- 2- oxo- 2,3- dihydro- 4H- imidazol- 4- ylidene)methyl]phenoxy}methyl)benzoicacid
Smiles: O=C1N=C(/C(=C\c2ccc(cc2)OCc2cccc(c2)C(=O)O)/N1)O

STK574204
Synonyms: 3- [(7- benzyl- 5,6- dimethyl- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl)amino]propan- 1- ol
Smiles: OCCCNc1ncnc2c1c(C)c(n2Cc1ccccc1)C

STK574206
Synonyms: 12- (furan- 2- yl)- 2- (2- methoxyphenyl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccccc1c1nc2n(n1)cnc1c2C(c2ccco2)C2=C(O1)CCCC2=O

STK848189
Synonyms: N- (4- butylphenyl)- 1- (3- methoxypropyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: CCCCc1ccc(cc1)NC(=O)c1cc2c(n1CCCOC)nc1n(c2=O)cccc1

STK574213
Synonyms: 2- (8- imino- 7- phenyl- 7H- benzo[7,8]chromeno[2,3- d]pyrimidin- 9(8H)- yl)- N,N- dimethylethanamine
Smiles: CN(CCn1cnc2c(c1=N)C(c1ccccc1)c1c(O2)c2ccccc2cc1)C

STK574216
Synonyms: 6- [2- (2- methoxyphenoxy)ethyl]- 7,10- dimethyl- 6H- indolo[2,3- b]quinoxaline
Smiles: COc1ccccc1OCCn1c2nc3ccccc3nc2c2c1c(C)ccc2C

STK848191
Synonyms: 2- (4- methoxyphenyl)- 6,7- dihydro- 5H- cyclopenta[d]pyrazolo[1,5- a]pyrimidin- 8- ol
Smiles: COc1ccc(cc1)c1cc2n(n1)c(O)c1c(n2)CCC1

STK848192
Synonyms: 2- amino- 5- (2,5- dimethoxyphenyl)- 4- hydroxy- 5,8- dihydropyrido[2,3- d]pyrimidin- 7(6H)- one
Smiles: COc1ccc(c(c1)C1CC(=O)Nc2c1c(O)nc(n2)N)OC

STK574220
Synonyms: (5E)- 3- (3- chlorophenyl)- 2- hydroxy- 5- {[1- (4- hydroxyphenyl)- 1H- pyrrol- 2- yl]methylidene}- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: Oc1ccc(cc1)n1cccc1/C=C\1/N=C(N(C1=O)c1cccc(c1)Cl)O

STK574222
Synonyms: 2- ({[(5E)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]acetyl}amino)- 5- hydroxybenzoicacid
Smiles: O=C(Nc1ccc(cc1C(=O)O)O)CN1C(=S)S/C(=C/c2ccccc2Cl)/C1=O

STK574224
Synonyms: (1Z)- 5- (4- chloro- 3- methylphenoxy)- 1- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)pentan- 2- one
Smiles: COc1cc2CCN/C(=C\C(=O)CCCOc3ccc(c(c3)C)Cl)/c2cc1OC

STK574226
Synonyms: 7- chloro- 1- (3- ethoxy- 4- hydroxyphenyl)- 2- (3- methoxypropyl)- 6- methyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COCCCN1C(=O)c2c(C1c1ccc(c(c1)OCC)O)c(=O)c1c(o2)cc(c(c1)Cl)C

STK574227
Synonyms: ethyl4,5- dimethyl- 2- {[(E)- (naphthalen- 1- ylamino)methylidene]amino}thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(/N=C/Nc2cccc3c2cccc3)sc(c1C)C

STK574228
Synonyms: N- (4- chlorobenzyl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- propoxybenzamide
Smiles: CCCOc1ccccc1C(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)Cl

STK574229
Synonyms: N- (3- bromobenzyl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- (2- nitrophenoxy)acetamide
Smiles: Brc1cccc(c1)CN(C1CCS(=O)(=O)C1)C(=O)COc1ccccc1[N+](=O)[O-]

STK574230
Synonyms: (5Z)- 5- [(6- hydroxy- 4- oxo- 4H- chromen- 3- yl)methylidene]- 3- phenyl- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Oc1ccc2c(c1)c(=O)c(co2)/C=C/1\SC(=S)N(C1=O)c1ccccc1

STK848193
Synonyms: 8- (2,5- dimethoxyphenyl)- 3- (furan- 2- ylmethyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1cc(OC)ccc1OC)Cc1ccco1

STK574233
Synonyms: 5- [(2- fluorobenzyl)oxy]- 2- [4- phenyl- 3- (trifluoromethyl)- 1,2- oxazol- 5- yl]phenol
Smiles: Oc1cc(ccc1c1onc(c1c1ccccc1)C(F)(F)F)OCc1ccccc1F

STK848194
Synonyms: N- [(2E)- 6- (dimethylsulfamoyl)- 1,3- benzothiazol- 2(3H)- ylidene]quinoline- 2- carboxamide
Smiles: O=C(c1ccc2c(n1)cccc2)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)N(C)C

STK574234
Synonyms: (5Z)- 5- [1- (cyclopropylamino)ethylidene]- 6- hydroxy- 3- (2- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C(/NC2CC2)\C)/C(=O)N1c1ccccc1C

STK574237
Synonyms: 11- chloro- 3- [2- methyl- 6- (propan- 2- yl)phenyl]- 3,4,8,9- tetrahydro- 2H- cyclopenta[3,4]chromeno[8,7- e][1,3]oxazin- 6(7H)- one
Smiles: CC(c1cccc(c1N1COc2c(C1)c1oc(=O)c3c(c1cc2Cl)CCC3)C)C

STK574242
Synonyms: 2- [(2,3- dimethylphenyl)amino]- 4- (3- methoxyphenyl)- 8- methyl- 4H- pyrimido[1,2- a][1,3,5]triazin- 6- ol
Smiles: COc1cccc(c1)C1N=C(Nc2cccc(c2C)C)N=c2n1c(O)cc(n2)C

STK574246
Synonyms: (3E)- 3- [2- (naphthalen- 1- yl)- 2- oxoethylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1Nc2c(/C/1=C\C(=O)c1cccc3c1cccc3)cccc2

STK848196
Synonyms: ethyl{[3- (4- methoxyphenyl)- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)OC)C(F)(F)F

STK848198
Synonyms: 6- benzyl- 3- (4- chlorophenyl)- 5- methylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)c(c2O)Cc1ccccc1

STK574257
Synonyms: 6- amino- 1- (4- fluorophenyl)- 3- methyl- 4- (thiophen- 2- yl)- 1H- pyrazolo[3,4- b]pyridine- 5- carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cccs1)c(C)nn2c1ccc(cc1)F

STK574258
Synonyms: 3- tert- butyl- 7- (3,4- dimethylphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Cc1ccc(cc1C)n1ncc2c1ncn1c2nnc1C(C)(C)C

STK574263
Synonyms: 2- [2- amino- 5- (2- methoxyphenyl)- 6- (trifluoromethyl)pyrimidin- 4- yl]- 5- [(4- fluorobenzyl)oxy]phenol
Smiles: COc1ccccc1c1c(nc(nc1C(F)(F)F)N)c1ccc(cc1O)OCc1ccc(cc1)F

STK574264
Synonyms: 4- {(2E)- 2- [(2- chloro- 7- methoxyquinolin- 3- yl)methylidene]hydrazinyl}benzoicacid
Smiles: COc1ccc2c(c1)nc(c(c2)/C=N/Nc1ccc(cc1)C(=O)O)Cl

STK574267
Synonyms: (5Z)- 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- methyl- 2,6- dioxo- 5- [4- (prop- 2- en- 1- yloxy)benzylidene]- 1,2,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: C=CCOc1ccc(cc1)/C=C/1\C(=O)N(C2CCS(=O)(=O)C2)C(=O)C(=C1C)C#N

STK574268
Synonyms: (5Z)- 5- ({3- [2- methyl- 4- (2- methylpropoxy)phenyl]- 1- phenyl- 1H- pyrazol- 4- yl}methylidene)- 3- (2- methylpropyl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CC(COc1ccc(c(c1)C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC(C)C)c1ccccc1)C

STK574269
Synonyms: 2- (6- chloro- 7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (3- hydroxypropyl)acetamide
Smiles: OCCCNC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl

STK574278
Synonyms: 2- ({5- [(1S)- 1- amino- 3- (methylsulfanyl)propyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)- N- (4- bromophenyl)acetamide
Smiles: CSCC[C@@H](c1nnc(o1)SCC(=O)Nc1ccc(cc1)Br)N

STK574281
Synonyms: (4E)- 2- (2- methoxyphenyl)- 4- [(pyrimidin- 2- ylamino)methylidene]isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccccc1N1C(=O)/C(=C/Nc2ncccn2)/c2c(C1=O)cccc2

STK574282
Synonyms: 1- [2- benzyl- 10- (4- methoxyphenyl)- 8- methyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: COc1ccc(cc1)C1C(=C(C)Oc2c1c1nc(nn1cn2)Cc1ccccc1)C(=O)C

STK848201
Synonyms: 2- [2- amino- 5- (3,4- dimethoxyphenyl)pyrimidin- 4- yl]- 5- [(2- methylbenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cnc(nc1c1ccc(cc1O)OCc1ccccc1C)N

STK574284
Synonyms: 6,8- dimethyl- 4- [(4- phenylpiperazin- 1- yl)methyl]- 2H- chromen- 2- one
Smiles: Cc1cc(C)c2c(c1)c(CN1CCN(CC1)c1ccccc1)cc(=O)o2

STK574287
Synonyms: 2- {(2E)- 4- hydroxy- 2- [(2E)- (2- oxo- 1,3- thiazolidin- 4- ylidene)hydrazinylidene]- 2,5- dihydro- 1,3- thiazol- 5- yl}- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CC1S/C(=N/N=C/2\CSC(=O)N2)/N=C1O

STK574288
Synonyms: 2- (2- phenyl- 4- thioxo- 5,6,7,8- tetrahydroquinazolin- 1(4H)- yl)ethylacetate
Smiles: CC(=O)OCCn1c(nc(=S)c2c1CCCC2)c1ccccc1

STK574292
Synonyms: [(5S)- 5- (benzylcarbamoyl)- 3- (2,3- dimethoxyphenyl)- 4,5- dihydro- 1,2- oxazol- 5- yl]aceticacid
Smiles: COc1c(OC)cccc1C1=NO[C@@](C1)(CC(=O)O)C(=O)NCc1ccccc1

STK574297
Synonyms: 4- {[(2Z)- 3- (4- chlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]amino}- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1)Cl)CS(=O)(=O)C2

STK574299
Synonyms: 2,11- di(furan- 2- yl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nn(c2c1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1ccco1)c1ccccc1

STK574302
Synonyms: 1- (3- hydroxyphenyl)- 2- (pyridin- 4- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Oc1cccc(c1)C1N(Cc2ccncc2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK574304
Synonyms: 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 1,3- dimethyl- 8- (methylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(=O)n(c(=O)n2C)C

STK574307
Synonyms: N- [5- (ethylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 5- (2- hydroxy- 3,4- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: CCSc1nnc(s1)NC(=O)c1n[nH]c(c1)c1ccc(c(c1O)C)C

STK848208
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1ccc(cc1)c1c(=O)c2ccc(cc2oc1C(F)(F)F)OCC(=O)N

STK574313
Synonyms: ethyl(4- hydroxy- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- yl)acetate
Smiles: CCOC(=O)Cc1cc(O)c2c(n1)[nH]n(c2=O)c1ccccc1

STK574314
Synonyms: 2- {(5E)- 5- [(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}ethanesulfonicacid
Smiles: CC1Oc2c(C1)cc(cc2)/C=C\1/SC(=S)N(C1=O)CCS(=O)(=O)O

STK574316
Synonyms: furan- 2- yl{4- [4- hydroxy- 6- (methoxymethyl)pyrimidin- 2- yl]piperazin- 1- yl}methanone
Smiles: COCc1cc(O)nc(n1)N1CCN(CC1)C(=O)c1ccco1

STK574317
Synonyms: (5Z)- 3- (2- fluorobenzyl)- 2- hydroxy- 5- {[5- (phenylsulfanyl)furan- 2- yl]methylidene}- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: OC1=N/C(=C\c2ccc(o2)Sc2ccccc2)/C(=O)N1Cc1ccccc1F

STK574323
Synonyms: N- [2- (2- phenylethyl)- 1,2,3,4- tetrahydropyrazino[1,2- a]benzimidazol- 8- yl]methanesulfonamide
Smiles: CS(=O)(=O)Nc1ccc2c(c1)nc1n2CCN(C1)CCc1ccccc1

STK574325
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (3- ethoxyphenyl)- 5- (2- hydroxyethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)OCC)c([nH]n2)c1cc(Cl)c(cc1O)C

STK574326
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (3- ethoxyphenyl)- 5- (3- hydroxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1cccc(c1)OCC)c([nH]n2)c1cc(Cl)c(cc1O)C

STK848210
Synonyms: 2- methoxyethyl1,2- dimethyl- 5- [(methylsulfonyl)oxy]- 1H- indole- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)n(c2c1cc(cc2)OS(=O)(=O)C)C

STK574333
Synonyms: 2- [4- (3- methoxyphenoxy)- 3- methyl- 1H- pyrazol- 5- yl]- 5- [(4- methylbenzyl)oxy]phenol
Smiles: COc1cccc(c1)Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1ccc(cc1)C

STK574334
Synonyms: 6- ethyl- 4- {[4- (4- methoxyphenyl)piperazin- 1- ium- 1- yl]methyl}- 2- oxo- 2H- chromen- 7- olate
Smiles: CCc1cc2c(cc1[O-])oc(=O)cc2C[NH+]1CCN(CC1)c1ccc(cc1)OC

STK848211
Synonyms: N- [3- (methylcarbamoyl)- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl]- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: CNC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)cccc3)sc2c1CCCC2

STK574343
Synonyms: [(5- {(1S)- 1- [(tert- butoxycarbonyl)amino]- 2- phenylethyl}- 1,3,4- oxadiazol- 2- yl)sulfanyl]aceticacid
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)SCC(=O)O)Cc1ccccc1

STK574348
Synonyms: ethyl(2Z)- 2- [(7,7- dimethyl- 5- oxo- 4- phenyl- 1,4,5,6,7,8- hexahydroquinazolin- 2- yl)imino]- 4- methyl- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: CCOC(=O)c1s/c(=N\C2=NC(C3=C(N2)CC(C)(C)CC3=O)c2ccccc2)/[nH]c1C

STK574349
Synonyms: 7- hydroxy- 2- (prop- 2- yn- 1- ylsulfanyl)- 5- (3,4,5- trimethoxyphenyl)- 5,6- dihydropyrido[2,3- d]pyrimidin- 4(3H)- one
Smiles: COc1cc(cc(c1OC)OC)C1CC(=Nc2c1c(=O)[nH]c(n2)SCC#C)O

STK574354
Synonyms: N- [(4- methylphenyl)carbamoyl]- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)Nc1ccc(cc1)C

STK574357
Synonyms: (1S,2S)- N'- [(E)- (2- hydroxy- 6- methylquinolin- 3- yl)methylidene]- 2- phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cc2cc(C)ccc2nc1O

STK848213
Synonyms: N- phenyl- 4- [2- (pyridin- 2- yl)- 1H- indol- 3- yl]butanamide
Smiles: O=C(Nc1ccccc1)CCCc1c([nH]c2c1cccc2)c1ccccn1

STK574362
Synonyms: (3Z)- 1- (4- acetylphenyl)- 3- (pyridin- 3- ylmethylidene)pyrrolidine- 2,5- dione
Smiles: CC(=O)c1ccc(cc1)N1C(=O)C/C(=C/c2cccnc2)/C1=O

STK574364
Synonyms: 9- propyl- 2- (thiophen- 2- yl)- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CCCN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1cccs1

STK848214
Synonyms: 6- chloro- N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Clc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C

STK574367
Synonyms: 5- {4- [(2- chlorobenzyl)oxy]phenyl}- N'- [(E)- pyridin- 3- ylmethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc(cc1)OCc1ccccc1Cl)N/N=C/c1cccnc1

STK574372
Synonyms: [1- methyl- 9- (4- methylphenyl)- 2,4- dioxo- 1,4,6,7,8,9- hexahydropyrimido[2,1- f]purin- 3(2H)- yl]aceticacid
Smiles: OC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)C

STK848217
Synonyms: (5Z)- 5- (1H- benzimidazol- 2- ylmethylidene)- 3- (2- methylphenyl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Cc1ccccc1N1C(=S)S/C(=C\c2nc3c([nH]2)cccc3)/C1=O

STK574381
Synonyms: N- {3- [(furan- 2- ylmethyl)carbamoyl]- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl}- 5- (2- hydroxyphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccccc1O)Nc1sc2c(c1C(=O)NCc1ccco1)CCCC2

STK574383
Synonyms: 3,4- diethoxy- N- [2- (1H- imidazol- 5- yl)ethyl]benzamide
Smiles: CCOc1cc(ccc1OCC)C(=O)NCCc1cnc[nH]1

STK574384
Synonyms: 2- {[(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}pyrimido[1,2- a]benzimidazol- 4- ol
Smiles: Cc1nnc(s1)SCc1cc(O)n2c(n1)nc1c2cccc1

STK574385
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 5- (5- chloro- 2- hydroxyphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Clc1ccc(c(c1)c1[nH]nc(c1)C(=O)NCc1ccc2c(c1)OCO2)O

STK574387
Synonyms: 2- chloro- 5- [(2E)- 2- (5- cyano- 6- hydroxy- 4- methyl- 2- oxopyridin- 3(2H)- ylidene)hydrazinyl]benzoicacid
Smiles: N#CC1=C(C)/C(=N\Nc2ccc(c(c2)C(=O)O)Cl)/C(=O)N=C1O

STK574391
Synonyms: 8- (4- benzylpiperidin- 1- yl)- 2- methyl- 3- phenyl- 6,7- dihydro- 5H- cyclopenta[d]pyrazolo[1,5- a]pyrimidine
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2N2CCC(CC2)Cc2ccccc2)CCC1

STK574394
Synonyms: (6Z)- 6- [(4- methylphenyl)imino]- 4- (trifluoromethyl)- 1,6- dihydro- 1,3,5- triazin- 2- amine
Smiles: Cc1ccc(cc1)/N=c/1\nc(nc([nH]1)N)C(F)(F)F

STK574398
Synonyms: 2- (4- fluorophenyl)- N- [(2E)- 3- (4- methoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: COc1ccc(cc1)CN1/C(=N\C(=O)Cc2ccc(cc2)F)/SC2C1CS(=O)(=O)C2

STK574399
Synonyms: N- {[3- (trifluoromethyl)phenyl]carbamoyl}- L- phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)Nc1cccc(c1)C(F)(F)F

STK574400
Synonyms: 5- bromo- N,3- dimethyl- N- (1- methylpiperidin- 4- yl)- 1H- indole- 2- carboxamide
Smiles: CN1CCC(CC1)N(C(=O)c1[nH]c2c(c1C)cc(cc2)Br)C

STK574401
Synonyms: N- [(2Z)- 5- (pyridin- 3- yl)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: CC(=O)/N=c\1/[nH]nc(s1)c1cccnc1

STK848224
Synonyms: [4- (8,10- dimethyl- 2- propylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidin- 4- yl)piperazin- 1- yl]acetonitrile
Smiles: CCCc1cc(N2CCN(CC2)CC#N)n2c(n1)c1c(C)cc(nc1n2)C

STK574405
Synonyms: N- [2- (dimethylamino)- 2- (furan- 2- yl)ethyl]- 5- fluoro- 3- methyl- 1- benzofuran- 2- carboxamide
Smiles: CN(C(c1ccco1)CNC(=O)c1oc2c(c1C)cc(cc2)F)C

STK574414
Synonyms: 5- hydroxy- 2- ({2- [(5E)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)benzoicacid
Smiles: O=C(C(N1C(=S)S/C(=C/c2cccs2)/C1=O)C)Nc1ccc(cc1C(=O)O)O

STK574421
Synonyms: 7- (furan- 2- yl)- 5- hydroxy- 2- methyl- N- (pyridin- 2- yl)- 4- (pyridin- 3- yl)- 4,6,7,8- tetrahydroquinoline- 3- carboxamide
Smiles: CC1=C(C(=O)Nc2ccccn2)C(C2=C(CC(CC2=N1)c1ccco1)O)c1cccnc1

STK574423
Synonyms: (5Z)- 6- hydroxy- 5- [(2E)- 1- hydroxy- 3- (pyridin- 4- yl)prop- 2- en- 1- ylidene]- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\C=C\c2ccncc2)/O)/C1=O)O

STK574425
Synonyms: 2- [4- (4- methoxyphenoxy)- 1H- pyrazol- 3- yl]- 5- [(4- methylbenzyl)oxy]phenol
Smiles: COc1ccc(cc1)Oc1c[nH]nc1c1ccc(cc1O)OCc1ccc(cc1)C

STK574429
Synonyms: 2- (4- methoxyphenyl)pyrimido[1,2- a]benzimidazol- 4- ol
Smiles: COc1ccc(cc1)c1cc(O)n2c(n1)nc1c2cccc1

STK574432
Synonyms: 4- (4- chlorophenyl)- 1- (2- methoxyphenyl)- 3- (thiophen- 3- yl)piperazine- 2,5- dione
Smiles: COc1ccccc1N1CC(=O)N(C(C1=O)c1cscc1)c1ccc(cc1)Cl

STK574433
Synonyms: [(benzylamino)(4- chlorophenyl)methyl](2- phenylethyl)phosphinicacid
Smiles: Clc1ccc(cc1)C(P(=O)(CCc1ccccc1)O)NCc1ccccc1

STK574438
Synonyms: N- (3- bromobenzyl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 3- propoxybenzamide
Smiles: CCCOc1cccc(c1)C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Br

STK574439
Synonyms: N- (cyclooctylcarbamoyl)- D- alanine
Smiles: C[C@H](C(=O)O)NC(=O)NC1CCCCCCC1

STK574442
Synonyms: 2- [(6- chloro- 4- ethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)propanamide
Smiles: CCc1cc(=O)oc2c1cc(Cl)c(c2)OC(C(=O)NCc1ccncc1)C

STK574444
Synonyms: 6- acetyl- 2- thioxo- 4- (trifluoromethyl)- 1,2,5,6,7,8- hexahydro- 1,6- naphthyridine- 3- carbonitrile
Smiles: N#Cc1c(=S)[nH]c2c(c1C(F)(F)F)CN(CC2)C(=O)C

STK574446
Synonyms: 8- [(4- benzylpiperazin- 1- yl)methyl]- 1,3- dimethyl- 7- (3- phenylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2CCCc1ccccc1)CN1CCN(CC1)Cc1ccccc1

STK574448
Synonyms: 8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1[nH]c2c(n1)n(C)c(=O)nc2O

STK574451
Synonyms: 3- (5,9- dimethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)propanoicacid
Smiles: CC1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)CCC(=O)O

STK848231
Synonyms: methyl4- [(4- fluorophenyl)carbamoyl]- 6- hydroxy- 2- methyl- 4,5- dihydropyridine- 3- carboxylate
Smiles: COC(=O)C1=C(C)N=C(CC1C(=O)Nc1ccc(cc1)F)O

STK574457
Synonyms: 2,4- dihydroxy- 5- (3- methoxyphenyl)- 1- (3- methoxypropyl)- 1,5- dihydro- 6H- indeno[2',1':5,6]pyrido[2,3- d]pyrimidin- 6- one
Smiles: COCCCn1c(O)nc(c2c1=NC1=C(C2c2cccc(c2)OC)C(=O)c2c1cccc2)O

STK574459
Synonyms: 4- [(2E)- 2- {[5- (2- nitrophenyl)furan- 2- yl]methylidene}hydrazinyl]- 5- phenylthieno[2,3- d]pyrimidine
Smiles: [O-][N+](=O)c1ccccc1c1ccc(o1)/C=N/Nc1ncnc2c1c(cs2)c1ccccc1

STK574466
Synonyms: 3- (2- {(E)- [2- hydroxy- 1- (4- methylbenzyl)- 5- oxo- 1,5- dihydro- 4H- imidazol- 4- ylidene]methyl}- 1H- pyrrol- 1- yl)benzoicacid
Smiles: Cc1ccc(cc1)CN1C(=N/C(=C/c2cccn2c2cccc(c2)C(=O)O)/C1=O)O

STK574469
Synonyms: 4- amino- N- (2- chlorobenzyl)- 3- (4- methoxyphenyl)- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: COc1ccc(cc1)n1c(=S)sc(c1N)C(=O)NCc1ccccc1Cl

STK574475
Synonyms: N- (3- methoxypropyl)- 11- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: COCCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2

STK574477
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- propyl- 1H- 1,2,3- triazole- 4- carboxylicacid
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)O

STK574482
Synonyms: 2- {[4- amino- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (5- bromopyridin- 2- yl)acetamide
Smiles: O=C(Nc1ccc(cn1)Br)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK848232
Synonyms: 4- hydroxy- 2- phenyl- 6- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]pyridin- 3- one
Smiles: CCCc1cc(O)c2c(n1)[nH]n(c2=O)c1ccccc1

STK848235
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- (4- ethylbenzyl)- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: CCc1ccc(cc1)CN(C(=O)c1cc(=O)c2c(o1)cccc2)C1CCS(=O)(=O)C1

STK574489
Synonyms: 3- [(2S)- 1- oxo- 1- (pyrrolidin- 1- yl)propan- 2- yl]- 1,2,3- benzotriazin- 4(3H)- one
Smiles: O=C([C@@H](n1nnc2c(c1=O)cccc2)C)N1CCCC1

STK848236
Synonyms: 2,5- dimethyl- 3- (4- methylphenyl)- N- [3- (morpholin- 4- yl)propyl]pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1ccc(cc1)c1c(C)nn2c1nc(C)cc2NCCCN1CCOCC1

STK574493
Synonyms: 6- chloro- 2- [(2- chloro- 6- fluorobenzyl)amino]- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Fc1cccc(c1CNc1nc2n(n1)c(O)c(c(n2)C)Cl)Cl

STK574494
Synonyms: N- (5- hydroxy- 2- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl)- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1cc(O)nc2n1nc(n2)c1ccccc1

STK574495
Synonyms: 2- [4- (4- chlorophenyl)- 3- methyl- 1,2- oxazol- 5- yl]- 5- [(4- fluorobenzyl)oxy]phenol
Smiles: Fc1ccc(cc1)COc1ccc(c(c1)O)c1onc(c1c1ccc(cc1)Cl)C

STK574496
Synonyms: 4- [4- (2,4- dimethylbenzyl)piperazin- 1- yl]- 2,8,10- trimethylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidine
Smiles: Cc1ccc(c(c1)C)CN1CCN(CC1)c1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK848237
Synonyms: N- cyclopentyl- 2- methyl- 3- phenyl- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazolin- 9- amine
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2NC2CCCC2)CCCC1

STK574500
Synonyms: 3- phenoxy- N- [(1- phenylcyclopentyl)methyl]propanamide
Smiles: O=C(NCC1(CCCC1)c1ccccc1)CCOc1ccccc1

STK574504
Synonyms: N- (5- chloro- 2- cyanophenyl)- 2- (7- methyl- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)acetamide
Smiles: N#Cc1ccc(cc1NC(=O)CN1CCc2c(C1C)cc1c(c2)OCCCO1)Cl

STK574506
Synonyms: N- cyclohexyl- 5,6- dimethylfuro[2,3- d]pyrimidin- 4- amine
Smiles: Cc1c(C)oc2c1c(NC1CCCCC1)ncn2

STK574509
Synonyms: 4- [(4- benzylpiperazin- 1- ium- 1- yl)methyl]- 2- oxo- 7- phenyl- 2H- chromen- 6- olate
Smiles: O=c1oc2cc(c3ccccc3)c(cc2c(c1)C[NH+]1CCN(CC1)Cc1ccccc1)[O-]

STK574511
Synonyms: 4- [({3- cyclohexyl- 3- [4- (propan- 2- yloxy)phenyl]propyl}amino)methyl]- N,N- dimethylaniline
Smiles: CC(Oc1ccc(cc1)C(C1CCCCC1)CCNCc1ccc(cc1)N(C)C)C

STK848240
Synonyms: 3- (3,4- dimethoxyphenyl)- 2,5- dimethyl- N- (2- phenylethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)cc2NCCc1ccccc1

STK574517
Synonyms: 4- butyl- N- [2- (furan- 2- yl)- 2- (morpholin- 4- yl)ethyl]cyclohexanecarboxamide
Smiles: CCCCC1CCC(CC1)C(=O)NCC(c1ccco1)N1CCOCC1

STK848241
Synonyms: 1- (2- fluorophenyl)- 2- methyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: O=C1N(C)C(c2c1oc1ccccc1c2=O)c1ccccc1F

STK848242
Synonyms: 2- [(4- fluorobenzyl)amino]- 5- propyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCCc1cc(O)n2c(n1)nc(n2)NCc1ccc(cc1)F

STK574521
Synonyms: 1- (4- chlorophenyl)- N- (3- methylphenyl)- 4- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Cc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)C)c1ccc(cc1)Cl

STK574524
Synonyms: 1- (3- ethoxy- 4- hydroxyphenyl)- 2- (4- methoxybenzyl)- 5,7- dimethyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cc(ccc1O)C1N(Cc2ccc(cc2)OC)C(=O)c2c1c(=O)c1c(o2)c(C)cc(c1)C

STK574525
Synonyms: 7- (4- ethylpiperazin- 1- yl)- 5- methyl- 3- (4- methylphenyl)pyrazolo[1,5- a]pyrimidine
Smiles: CCN1CCN(CC1)c1cc(C)nc2n1ncc2c1ccc(cc1)C

STK574529
Synonyms: 2- [(3- benzyl- 4,7- dimethyl- 2- oxo- 2H- chromen- 5- yl)oxy]- N- (pyridin- 2- ylmethyl)acetamide
Smiles: O=C(COc1cc(C)cc2c1c(C)c(c(=O)o2)Cc1ccccc1)NCc1ccccn1

STK574530
Synonyms: 2- cyclohexyl- 3- (2- methoxyethyl)- 10- methylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)C1CCCCC1

STK848244
Synonyms: 2,5- dimethyl- 3- (4- methylphenyl)- N- (2- phenylethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1ccc(cc1)c1c(C)nn2c1nc(C)cc2NCCc1ccccc1

STK848245
Synonyms: 2- {[3- cyano- 6- hydroxy- 4- (4- methylphenyl)- 4,5- dihydropyridin- 2- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)N=C(CC1c1ccc(cc1)C)O

STK574534
Synonyms: propyl4- [(5- {4- [(2,5- dimethylbenzyl)oxy]- 2- hydroxyphenyl}- 1H- pyrazol- 4- yl)oxy]benzoate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1cn[nH]c1c1ccc(cc1O)OCc1cc(C)ccc1C

STK574536
Synonyms: 4- (2,4- dihydroxy- 1- methyl- 6- oxo- 5,6- dihydro- 1H- indeno[2',1':5,6]pyrido[2,3- d]pyrimidin- 5- yl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)C1C2=C(N=c3c1c(O)nc(n3C)O)c1c(C2=O)cccc1

STK574537
Synonyms: N- [2- chloro- 5- (trifluoromethyl)phenyl]- 5- hydroxy- 7,7- dimethyl- 2- oxo- 2,3,4,6,7,8- hexahydroquinoline- 4- carboxamide
Smiles: O=C1N=C2CC(C)(C)CC(=C2C(C1)C(=O)Nc1cc(ccc1Cl)C(F)(F)F)O

STK574539
Synonyms: N- [(2Z)- 6- methyl- 1,3- benzothiazol- 2(3H)- ylidene]- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Cc1ccc2c(c1)s/c(=N\C(=O)c1cc(=O)c3c(o1)cccc3)/[nH]2

STK848246
Synonyms: 8- (4- methoxyphenyl)- 6- oxo- 3- phenyl- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)OC)c1ccccc1

STK574543
Synonyms: N- tert- butyl- 2- {[3- cyano- 4- (furan- 2- yl)- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)NC(C)(C)C)N=C2C(=C(O)CCC2)C1c1ccco1

STK574545
Synonyms: N- (3- bromobenzyl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- propoxybenzamide
Smiles: CCCOc1ccccc1C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Br

STK574546
Synonyms: 7- chloro- 3- phenyl- 5- (propan- 2- yl)pyrazolo[1,5- a]pyrimidine
Smiles: CC(c1cc(Cl)n2c(n1)c(cn2)c1ccccc1)C

STK574548
Synonyms: N- ({4- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]phenyl}carbonyl)- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK574550
Synonyms: 2- {[4- amino- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- bromo- 2- fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1F)Br)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK574553
Synonyms: (5E)- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 6- hydroxy- 3- (3- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CN(CCCN/C=C/1\C(=NC(=O)N(C1=O)c1cccc(c1)C)O)C

STK574555
Synonyms: (4E)- 2- (3,4- dimethylphenyl)- 4- [(pyridin- 2- ylamino)methylidene]isoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1N(c2ccc(c(c2)C)C)C(=O)c2c(/C/1=C\Nc1ccccn1)cccc2

STK574557
Synonyms: 1- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- N- (3,5- dimethoxyphenyl)- 5- oxo- L- prolinamide
Smiles: COc1cc(cc(c1)OC)NC(=O)[C@@H]1CCC(=O)N1C1OC(=O)c2c1ccc(c2OC)OC

STK574561
Synonyms: (4E)- 2- (2,5- dimethoxyphenyl)- 4- {[(pyridin- 2- ylmethyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(c(c1)N1C(=O)/C(=C/NCc2ccccn2)/c2c(C1=O)cccc2)OC

STK574562
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (3,4- diethoxyphenyl)- 5- (pyridin- 3- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCOc1cc(ccc1OCC)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(Cl)c(cc1O)C

STK574566
Synonyms: N,N- diethyl- 2- (7- ethyl- 2- methyl- 4H- [1,3]thiazolo[5,4- b]indol- 4- yl)ethanamine
Smiles: CCN(CCn1c2ccc(cc2c2c1sc(n2)C)CC)CC

STK574570
Synonyms: 2- hydroxy- 4- ({(E)- [2- (6- methylpyridin- 2- yl)- 1,3- dioxo- 2,3- dihydroisoquinolin- 4(1H)- ylidene]methyl}amino)benzoicacid
Smiles: Cc1cccc(n1)N1C(=O)/C(=C/Nc2ccc(c(c2)O)C(=O)O)/c2c(C1=O)cccc2

STK574573
Synonyms: tert- butyl(3S)- 3- ({(2R)- 1- [(2,4- dimethylphenyl)amino]- 1- oxopropan- 2- yl}carbamoyl)- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: Cc1ccc(c(c1)C)NC(=O)[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

STK848251
Synonyms: N- (2- bromophenyl)- 2- (4- hydroxy- 2- imino- 2,5- dihydro- 1,3- thiazol- 5- yl)acetamide
Smiles: O=C(Nc1ccccc1Br)CC1SC(=N)N=C1O

STK574578
Synonyms: 7- bromo- 2- (3- hydroxypropyl)- 1- (4- methoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: OCCCN1C(=O)c2c(C1c1ccc(cc1)OC)c(=O)c1c(o2)ccc(c1)Br

STK574579
Synonyms: N- [2- (dimethylamino)ethyl]- 5- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CN(CCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCCC2)C

STK574582
Synonyms: (4E)- 2- (3,4- dimethylphenyl)- 4- {[(1,1- dioxidotetrahydrothiophen- 3- yl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1N(c2ccc(c(c2)C)C)C(=O)c2c(/C/1=C\NC1CCS(=O)(=O)C1)cccc2

STK848255
Synonyms: methyl{[3- (biphenyl- 4- yloxy)- 4- oxo- 4H- chromen- 7- yl]oxy}acetate
Smiles: COC(=O)COc1ccc2c(c1)occ(c2=O)Oc1ccc(cc1)c1ccccc1

STK574594
Synonyms: methylN- {[2- (trifluoromethyl)phenyl]carbamoyl}- D- leucinate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccccc1C(F)(F)F)CC(C)C

STK574598
Synonyms: 5- (6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinolin- 1- yl)- 3- ethyl- 2,6- dihydroxypyrimidin- 4(3H)- one
Smiles: COc1cc2c(cc1OC)CCNC2c1c(O)nc(n(c1=O)CC)O

STK574599
Synonyms: 2,8,10- trimethyl- 4- {4- [2- (naphthalen- 1- yloxy)ethyl]piperazin- 1- yl}pyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidine
Smiles: Cc1cc(N2CCN(CC2)CCOc2cccc3c2cccc3)n2c(n1)c1c(C)cc(nc1n2)C

STK574600
Synonyms: N- [3- (2,2- dimethyltetrahydro- 2H- pyran- 4- yl)- 6- methylheptyl]- 4- methylcyclohexanamine
Smiles: CC(CCC(C1CCOC(C1)(C)C)CCNC1CCC(CC1)C)C

STK574602
Synonyms: 4- (3,4,5- trimethoxyphenyl)- 4,10- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: COc1cc(cc(c1OC)OC)C1N=C(N)N=c2n1c1ccccc1[nH]2

STK574603
Synonyms: (2E)- 3- (5,9- dimethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)prop- 2- enoicacid
Smiles: CC1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)/C=C/C(=O)O

STK574605
Synonyms: ethyl10- (3,4- dimethoxyphenyl)- 8- methyl- 2- (pyridin- 4- yl)- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 9- carboxylate
Smiles: CCOC(=O)C1=C(C)Oc2c(C1c1ccc(c(c1)OC)OC)c1nc(nn1cn2)c1ccncc1

STK574610
Synonyms: [(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 2- (2- fluorophenyl)- 4,5- dioxopyrrolidin- 1- yl]aceticacid
Smiles: OC(=O)CN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccccc1F

STK574616
Synonyms: N'- [(E)- (2,5- dimethoxyphenyl)methylidene]- 2- (3- hydroxy- 5- methyl- 4H- pyrazol- 4- yl)acetohydrazide
Smiles: COc1ccc(c(c1)/C=N/NC(=O)CC1C(=NN=C1O)C)OC

STK848258
Synonyms: 2- [4- (4- chlorophenyl)- 3- methyl- 1,2- oxazol- 5- yl]- 5- ethoxyphenol
Smiles: CCOc1ccc(c(c1)O)c1onc(c1c1ccc(cc1)Cl)C

STK574617
Synonyms: N- butyl- 4- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]benzamide
Smiles: CCCCNC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK848259
Synonyms: 3- (4- fluorophenyl)- 8- (2- methoxyphenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccccc1OC)c1ccc(cc1)F

STK574618
Synonyms: 7- (4- fluorophenyl)- 2,7- dihydro- 3H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine- 3- thione
Smiles: Fc1ccc(cc1)n1ncc2c1ncn1c2n[nH]c1=S

STK574623
Synonyms: N- {[2- (4- fluorophenyl)ethyl]carbamoyl}- L- leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)NCCc1ccc(cc1)F)C

STK848261
Synonyms: 2- [2- amino- 5- (2- methoxyphenoxy)pyrimidin- 4- yl]- 5- [(4- ethenylbenzyl)oxy]phenol
Smiles: COc1ccccc1Oc1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1)C=C)N

STK574628
Synonyms: (2E)- 4- [(1,3- dimethyl- 2,4,6- trioxo- 1,1',2',3,3',3a',4,6- octahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinolin]- 7'- yl)amino]- 4- oxobut- 2- enoicacid
Smiles: O=C(Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)/C=C/C(=O)O

STK574630
Synonyms: 2- [(4- methoxybenzyl)amino]- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7(3H)- one
Smiles: COc1ccc(cc1)CNc1nn2c([nH]1)nc(cc2=O)C

STK574632
Synonyms: 1- [2- (2- hydroxyphenyl)- 10- (4- methoxyphenyl)- 8- methyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: COc1ccc(cc1)C1C(=C(C)Oc2c1c1nc(nn1cn2)c1ccccc1O)C(=O)C

STK574636
Synonyms: 3- {[5,6- dimethyl- 7- (4- methylphenyl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl]amino}propan- 1- ol
Smiles: OCCCNc1ncnc2c1c(C)c(n2c1ccc(cc1)C)C

STK574642
Synonyms: 2- [(4- chlorophenoxy)methyl]- 12- (furan- 2- yl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: Clc1ccc(cc1)OCc1nc2n(n1)cnc1c2C(c2ccco2)C2=C(O1)CCCC2=O

STK574643
Synonyms: methyl2- {[(2Z)- 2- (biphenyl- 4- ylmethylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}propanoate
Smiles: COC(=O)C(Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)c1ccccc1)/C2=O)C

STK848262
Synonyms: 3- (2- chlorophenyl)- 5- methyl- N- (pyridin- 3- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1cc(NCc2cccnc2)n2c(n1)c(cn2)c1ccccc1Cl

STK848263
Synonyms: 7- (4- methoxyphenyl)- 2- oxo- 1,3- benzoxathiol- 5- ylfuran- 2- carboxylate
Smiles: COc1ccc(cc1)c1cc(OC(=O)c2ccco2)cc2c1oc(=O)s2

STK574647
Synonyms: 6,7- dimethoxy- 2- (propylsulfonyl)- 1,2,3,4- tetrahydroisoquinoline
Smiles: CCCS(=O)(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STK848264
Synonyms: (5- bromofuran- 2- yl)[2- (4- methoxyphenyl)- 6,7- dihydro[1,3]thiazolo[5,4- c]pyridin- 5(4H)- yl]methanone
Smiles: COc1ccc(cc1)c1nc2c(s1)CN(CC2)C(=O)c1ccc(o1)Br

STK574666
Synonyms: N- benzyl- N- methyl- 4,5,6,7- tetrahydro- 2H- indazole- 3- carboxamide
Smiles: CN(C(=O)c1[nH]nc2c1CCCC2)Cc1ccccc1

STK574667
Synonyms: (2S)- N- (2- chlorophenyl)- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: Clc1ccccc1NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C

STK848266
Synonyms: 4- methyl- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (tetrahydrofuran- 2- ylmethyl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(Cc1cc2cccc(c2[nH]c1=O)C)CC1CCCO1

STK574671
Synonyms: 6- (3,4- dimethoxybenzyl)- 7,10- dimethyl- 6H- indolo[2,3- b]quinoxaline
Smiles: COc1cc(ccc1OC)Cn1c2nc3ccccc3nc2c2c1c(C)ccc2C

STK574673
Synonyms: N- {6- hydroxy- 7- [2- hydroxy- 3- (3- methylphenoxy)propyl]- 3- methyl- 2- oxo- 3,7- dihydro- 2H- purin- 8- yl}phenylalanine
Smiles: Cc1cccc(c1)OCC(Cn1c(NC(C(=O)O)Cc2ccccc2)nc2c1c(O)nc(=O)n2C)O

STK574676
Synonyms: 1'- butyl- 2'- hydroxy- 12- methyl- 15,16- dihydro- 4'H,4bH,6H,7H- spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1- a]isoquinoline- 5,5'- pyrimidine]- 4',6',7(1'H)- trione
Smiles: CCCCN1C(=NC(=O)C2(C1=O)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C)O

STK574677
Synonyms: 3- (4- chlorophenyl)- 5- (6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2,6- dihydroxypyrimidin- 4(3H)- one
Smiles: COc1cc2c(cc1OC)CCNC2c1c(O)nc(n(c1=O)c1ccc(cc1)Cl)O

STK574679
Synonyms: N- [(2E)- 5,5- dioxido- 3- (prop- 2- en- 1- yl)tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclohexanecarboxamide
Smiles: C=CCN1/C(=N\C(=O)C2CCCCC2)/SC2C1CS(=O)(=O)C2

STK574689
Synonyms: 4- imino- 5- (2- methoxyphenyl)- 3- [2- (morpholin- 4- yl)ethyl]- 3,5- dihydro- 4H- chromeno[2,3- d]pyrimidin- 8- ol
Smiles: COc1ccccc1C1c2ccc(cc2Oc2c1c(=N)n(cn2)CCN1CCOCC1)O

STK574692
Synonyms: 6- benzyl- 2- phenyl- 5,6,7,8- tetrahydropyrido[4,3- d]pyrimidin- 4(3H)- one
Smiles: O=c1[nH]c(nc2c1CN(CC2)Cc1ccccc1)c1ccccc1

STK574695
Synonyms: methyl4- {[(3Z)- 1- (2- methylpropyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]amino}- 4- oxobutanoate
Smiles: COC(=O)CCC(=O)/N=c/1\[nH]n(c2c1cc1ccccc1n2)CC(C)C

STK574698
Synonyms: (2E)- 3- (2- chlorophenyl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- [4- (propan- 2- yl)benzyl]prop- 2- enamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)C(C)C)/C=C/c1ccccc1Cl

STK574705
Synonyms: 2- (3,4- dimethoxyphenyl)- 5- [(1- phenylethyl)amino]- 1,3- oxazole- 4- carbonitrile
Smiles: N#Cc1nc(oc1NC(c1ccccc1)C)c1ccc(c(c1)OC)OC

STK574706
Synonyms: 5- [(3,4- dichlorobenzyl)oxy]- 2- [5- (2- ethoxyphenoxy)pyrimidin- 4- yl]phenol
Smiles: CCOc1ccccc1Oc1cncnc1c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl

STK848269
Synonyms: N- [(2Z)- 4- hydroxy- 1,3- thiazol- 2(5H)- ylidene]- 2- [(5- phenyl[1,3]thiazolo[2,3- c][1,2,4]triazol- 3- yl)sulfanyl]acetamide
Smiles: O=C(/N=C/1\SCC(=N1)O)CSc1nnc2n1c(cs2)c1ccccc1

STK574709
Synonyms: methyl4- [(3- {2- hydroxy- 4- [(4- methylbenzyl)oxy]phenyl}- 1H- pyrazol- 4- yl)oxy]benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1c[nH]nc1c1ccc(cc1O)OCc1ccc(cc1)C

STK848270
Synonyms: 8- (2- chlorophenyl)- 3- (4- methoxyphenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccccc1Cl)c1ccc(cc1)OC

STK574710
Synonyms: 1- (4- methylphenyl)- 2- (pyridin- 4- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1ccc(cc1)C1N(Cc2ccncc2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK574711
Synonyms: 3- methyl- 11- phenyl- 2,3,4,11- tetrahydrodibenzo[b,e][1,4]thiazepin- 1- ol
Smiles: CC1CC(=C2C(=Nc3ccccc3SC2c2ccccc2)C1)O

STK574719
Synonyms: 5- (2- hydroxy- 5- methylphenyl)- N- {2- [(4- methylphenyl)carbonyl]- 1- benzofuran- 3- yl}- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(cc1)C(=O)c1oc2c(c1NC(=O)c1n[nH]c(c1)c1cc(C)ccc1O)cccc2

STK574725
Synonyms: quinazoline- 2,4- diol
Smiles: Oc1nc2ccccc2c(n1)O

STK848271
Synonyms: N- [(2E)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]- 2- [(5- nitropyridin- 2- yl)sulfanyl]acetamide
Smiles: O=C(/N=c\1/scc([nH]1)C)CSc1ccc(cn1)[N+](=O)[O-]

STK574728
Synonyms: N- [4- ([1,2,4]triazolo[4,3- a]quinoxalin- 4- yloxy)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)Oc1nc2ccccc2n2c1nnc2

STK574730
Synonyms: (4E)- 4- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)- 2- (2- nitrophenyl)isoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1/C(=C/NCCCN2CCOCC2)/c2ccccc2C(=O)N1c1ccccc1[N+](=O)[O-]

STK574732
Synonyms: [(5S)- 3- [2- (2- amino- 2- oxoethoxy)phenyl]- 5- (cyclohexylcarbamoyl)- 4,5- dihydro- 1,2- oxazol- 5- yl]aceticacid
Smiles: OC(=O)C[C@]1(ON=C(C1)c1ccccc1OCC(=O)N)C(=O)NC1CCCCC1

STK574733
Synonyms: 3- amino- 6- hydroxy- 4- phenyl- 4,5- dihydrothieno[2,3- b]pyridine- 2- carboxamide
Smiles: OC1=Nc2sc(c(c2C(C1)c1ccccc1)N)C(=O)N

STK574734
Synonyms: 4- methoxy- N- (tetrahydrofuran- 2- ylmethyl)- 1H- indole- 2- carboxamide
Smiles: COc1cccc2c1cc([nH]2)C(=O)NCC1CCCO1

STK848272
Synonyms: 1- [(2Z)- 5- (ethylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 3- (1,1,1,3,3,3- hexafluoro- 2- methylpropan- 2- yl)urea
Smiles: CCSc1n[nH]/c(=N/C(=O)NC(C(F)(F)F)(C(F)(F)F)C)/s1

STK848273
Synonyms: (2Z)- 3- (3- bromo- 4- hydroxy- 5- methoxyphenyl)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/c1cc(Br)c(c(c1)OC)O)/c1scc(n1)c1ccc(cc1)Br

STK574735
Synonyms: 2- [(1E)- 1- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)ethyl]hydrazinecarboxamide
Smiles: NC(=O)NN/C(=C/1\C(=NC(=NC1=O)O)O)/C

STK574737
Synonyms: 8- (3- chlorophenyl)- 10- methyl- 11- (pyridin- 3- yl)- 2- (thiophen- 2- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1cccc(c1)n1nc(c2c1Oc1ncn3c(c1C2c1cccnc1)nc(n3)c1cccs1)C

STK848274
Synonyms: 1- (3- methoxypropyl)- N- (3- methylbutyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)NCCC(C)C

STK574738
Synonyms: 2- (4- ethylpiperazin- 1- yl)- 5,6,7,8- tetrahydroquinazolin- 4- ol
Smiles: CCN1CCN(CC1)c1nc(O)c2c(n1)CCCC2

STK574739
Synonyms: 2- [2- amino- 5- (2- bromophenoxy)- 6- methylpyrimidin- 4- yl]- 5- [(3,4- dichlorobenzyl)oxy]phenol
Smiles: Nc1nc(C)c(c(n1)c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl)Oc1ccccc1Br

STK574741
Synonyms: methylN- {(E)- [4,6- dioxo- 1- (prop- 2- en- 1- yl)- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}tryptophanate
Smiles: C=CCN1C(=NC(=O)/C(=C\NC(C(=O)OC)Cc2c[nH]c3c2cccc3)/C1=O)S

STK574744
Synonyms: 12- (3,4- dimethoxyphenyl)- 2- (pyridin- 3- yl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccc(cc1OC)C1C2=C(CCCC2=O)Oc2c1c1nc(nn1cn2)c1cccnc1

STK574746
Synonyms: (4E,5Z)- 4- [(4- ethoxyphenyl)imino]- 5- (4- hydroxy- 3- methoxybenzylidene)- 4,5- dihydro- 1,3- thiazol- 2- ol
Smiles: CCOc1ccc(cc1)/N=C\1/N=C(S/C1=C\c1ccc(c(c1)OC)O)O

STK848276
Synonyms: 3- (2- ethoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- ylcyclopropanecarboxylate
Smiles: CCOc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OC(=O)C1CC1

STK574751
Synonyms: 4- [(4- benzylpiperazin- 1- yl)methyl]- 6,7- dimethyl- 2H- chromen- 2- one
Smiles: O=c1cc(CN2CCN(CC2)Cc2ccccc2)c2c(o1)cc(c(c2)C)C

STK574758
Synonyms: 2,12- diphenyl- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: O=C1CCCC2=C1C(c1ccccc1)c1c(O2)ncn2c1nc(n2)c1ccccc1

STK574760
Synonyms: (2Z)- 6- [(4- bromobenzyl)oxy]- 2- (2H- chromen- 3- ylmethylidene)- 1- benzofuran- 3(2H)- one
Smiles: Brc1ccc(cc1)COc1ccc2c(c1)O/C(=C\C1=Cc3c(OC1)cccc3)/C2=O

STK574764
Synonyms: (2S)- 2- (4- oxoquinazolin- 3(4H)- yl)- N- [4- (propan- 2- yl)phenyl]propanamide
Smiles: O=C([C@@H](n1cnc2c(c1=O)cccc2)C)Nc1ccc(cc1)C(C)C

STK574768
Synonyms: (4E)- 2- (2- chlorophenyl)- 4- ({[(1- ethylpyrrolidin- 2- yl)methyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccccc1Cl

STK574771
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK848280
Synonyms: 3- (2,4- dimethoxyphenyl)- 8- (4- fluorophenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)F)c1ccc(cc1OC)OC

STK574775
Synonyms: 5- [(2- methoxybenzyl)amino]- 2- (morpholin- 4- ium- 4- yl)benzoate
Smiles: COc1ccccc1CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK848282
Synonyms: ethyl{[(2Z)- 2- (furan- 2- ylmethylidene)- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1C)O/C(=C\c1ccco1)/C2=O

STK848283
Synonyms: N- [4- (3,4- dimethoxyphenyl)- 1,2,5- oxadiazol- 3- yl]propanamide
Smiles: CCC(=O)Nc1nonc1c1ccc(c(c1)OC)OC

STK574786
Synonyms: ethyl1- [(5- methoxy- 3- methyl- 1H- indol- 2- yl)carbonyl]piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)C(=O)c1[nH]c2c(c1C)cc(cc2)OC

STK848285
Synonyms: 1- (3- methyl- 1,1- dioxidotetrahydrothiophen- 3- yl)- 3- prop- 2- en- 1- ylurea
Smiles: C=CCNC(=O)NC1(C)CCS(=O)(=O)C1

STK574791
Synonyms: 3- (3- hydroxypropyl)- 1- methyl- 8- (4- methylphenyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)C

STK574794
Synonyms: ethyl5- amino- 1- [3- (2- methoxyphenyl)- 2,5- dimethylpyrazolo[1,5- a]pyrimidin- 7- yl]- 1H- pyrazole- 4- carboxylate
Smiles: CCOC(=O)c1cnn(c1N)c1cc(C)nc2n1nc(c2c1ccccc1OC)C

STK574800
Synonyms: N- [(2- chlorobenzyl)carbamoyl]- L- leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)NCc1ccccc1Cl)C

STK574801
Synonyms: (5E)- 5- [(6- chloro- 4- oxo- 4H- chromen- 3- yl)methylidene]- 6- hydroxy- 3- (4- methoxyphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C\c2coc3c(c2=O)cc(cc3)Cl)/C1=O)O

STK848286
Synonyms: 5- tert- butyl- 3- (4- chlorophenyl)- N- (2- phenylethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(cc2NCCc1ccccc1)C(C)(C)C

STK848289
Synonyms: 3- (4- chlorophenyl)- 5- methyl- N- (2- phenylethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)cc2NCCc1ccccc1

STK574805
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- {[methyl(phenyl)amino]methyl}- N'- [(1E)- 1- (pyridin- 2- yl)ethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CN(c1ccccc1)C)C(=O)N/N=C(/c1ccccn1)\C

STK574810
Synonyms: 1- (3- methoxypropyl)- 4- oxo- N- [3- (propan- 2- yloxy)propyl]- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)NCCCOC(C)C

STK574813
Synonyms: 7- [4- (diphenylmethyl)piperazin- 1- yl]- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Cc1cc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)n2c(n1)ncn2

STK574815
Synonyms: 7,9- dimethoxy[1,2,4]triazino[4,5- a]indol- 1- ol
Smiles: COc1cc(OC)cc2c1cc1n2cnnc1O

STL036512
Synonyms: N- [(2Z)- 6- methoxy- 1,3- benzothiazol- 2(3H)- ylidene]- 6,7- dimethyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: COc1ccc2c(c1)s/c(=N\C(=O)c1cc(=O)c3c(o1)cc(c(c3)C)C)/[nH]2

STK574830
Synonyms: 7- chloro- 1- (3- ethoxy- 4- hydroxyphenyl)- 6- methyl- 2- [3- (propan- 2- yloxy)propyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cc(ccc1O)C1N(CCCOC(C)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK574834
Synonyms: 6- (azepanium- 1- ylmethyl)- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCCCC1)oc(=O)c1c2CCC1

STK848295
Synonyms: 4- [3- (4- chlorophenyl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazol- 5- yl]- N,N- dimethylaniline
Smiles: Clc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)N(C)C)S(=O)(=O)C

STK848296
Synonyms: N,1- bis(3- methoxypropyl)- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCNC(=O)c1cc2c(n1CCCOC)nc1n(c2=O)cccc1C

STK574837
Synonyms: 4- {(E)- [5- iminio- 7- oxo- 2- (pyridin- 4- yl)- 5H- [1,3,4]thiadiazolo[3,2- a]pyrimidin- 6(7H)- ylidene]methyl}benzoate
Smiles: O=C1N=c2sc(nn2C(=[NH2+])/C/1=C\c1ccc(cc1)C(=O)[O-])c1ccncc1

STK574840
Synonyms: 2- [2- oxo- 2- (3,3,5,5- tetramethyl- 1,3,4,5- tetrahydro- 2H- 2- benzazepin- 2- yl)ethyl]- 1,2- benzothiazol- 3(2H)- one1,1- dioxide
Smiles: O=C(N1Cc2ccccc2C(CC1(C)C)(C)C)CN1C(=O)c2c(S1(=O)=O)cccc2

STK574841
Synonyms: 4- amino- N- (4- methoxybenzyl)- 3- phenyl- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1sc(=S)n(c1N)c1ccccc1

STK848299
Synonyms: 2- [2- amino- 5- (3- methoxyphenoxy)pyrimidin- 4- yl]- 5- [(2,5- dimethylbenzyl)oxy]phenol
Smiles: COc1cccc(c1)Oc1cnc(nc1c1ccc(cc1O)OCc1cc(C)ccc1C)N

STK574845
Synonyms: (2Z)- 6- [(4- bromobenzyl)oxy]- 2- (pyridin- 4- ylmethylidene)- 1- benzofuran- 3(2H)- one
Smiles: Brc1ccc(cc1)COc1ccc2c(c1)O/C(=C\c1ccncc1)/C2=O

STK574851
Synonyms: 5- [(2- chlorobenzyl)oxy]- 2- [4- (4- methoxyphenyl)- 3- methyl- 1,2- oxazol- 5- yl]phenol
Smiles: COc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1ccccc1Cl

STK574852
Synonyms: 5- cyano- 4- (furan- 2- yl)- 2- methyl- 6- {[2- oxo- 2- (1,3- thiazol- 2- ylamino)ethyl]sulfanyl}- N- (4- sulfamoylphenyl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)NC(=C(C1c1ccco1)C(=O)Nc1ccc(cc1)S(=O)(=O)N)C

STK574854
Synonyms: [(5E)- 5- (3,4- dihydroxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl](phenyl)aceticacid
Smiles: OC(=O)C(N1C(=S)S/C(=C/c2ccc(c(c2)O)O)/C1=O)c1ccccc1

STK574859
Synonyms: N- (4- chlorophenyl)- 2- hydroxy- 5- oxo- 7- phenyl- 3,4,5,6,7,8- hexahydroquinoline- 4- carboxamide
Smiles: OC1=NC2=C(C(C1)C(=O)Nc1ccc(cc1)Cl)C(=O)CC(C2)c1ccccc1

STK574864
Synonyms: (1Z)- 6,7- dimethoxy- 1- {[(4- methoxyphenyl)sulfonyl]methylidene}- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1ccc(cc1)S(=O)(=O)/C=C/1\NCCc2c1cc(OC)c(c2)OC

STK574867
Synonyms: 1- benzyl- N- (3,4- dimethoxyphenyl)- 7- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cc(cc1)C

STK848300
Synonyms: N- (4- fluorophenyl)- 2,8,10- trimethylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidin- 4- amine
Smiles: Fc1ccc(cc1)Nc1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK574869
Synonyms: 2- (2- amino- 5- phenylpyrimidin- 4- yl)- 5- [(3,4- dichlorobenzyl)oxy]phenol
Smiles: Nc1ncc(c(n1)c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl)c1ccccc1

STK574871
Synonyms: 6- hydroxy- 7- (2- hydroxyethyl)- 3- methyl- 8- [(3- methylbutyl)amino]- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCn1c(NCCC(C)C)nc2c1c(O)nc(=O)n2C

STK574874
Synonyms: (4E)- 2- (2- methoxyphenyl)- 4- {[(pyridin- 2- ylmethyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccccc1N1C(=O)/C(=C/NCc2ccccn2)/c2c(C1=O)cccc2

STK574881
Synonyms: N- [(6- chloro- 7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetyl]- L- phenylalanyl- L- alanine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccccc1

STK574884
Synonyms: 6- amino- 1- (4- fluorobenzyl)- 2- sulfanylpyrimidin- 4(1H)- one
Smiles: Fc1ccc(cc1)Cn1c(N)cc(=O)nc1S

STK848302
Synonyms: 3- (3- hydroxypropyl)- 1,6,7- trimethyl- 8- (2- methylphenyl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)c1ccccc1C

STK574887
Synonyms: 2- (1H- benzimidazol- 2- yl)- 4- chloro- 5- {[2- (2,4- dichlorophenyl)ethyl]amino}pyridazin- 3(2H)- one
Smiles: Clc1ccc(c(c1)Cl)CCNc1cnn(c(=O)c1Cl)c1nc2c([nH]1)cccc2

STK574888
Synonyms: N- [2',6'- dihydroxy- 3- (2- methoxyphenyl)- 4'- oxo- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidin]- 8- yl]acetamide
Smiles: COc1ccccc1N1CCN2C(C1)C1(Cc3c2ccc(c3)NC(=O)C)C(=NC(=NC1=O)O)O

STK574894
Synonyms: 2- (7- methoxy- 4,8- dimethyl- 2- oxo- 2H- chromen- 3- yl)- N- [2- (morpholin- 4- yl)ethyl]acetamide
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)NCCN1CCOCC1

STK574896
Synonyms: (5Z)- 1- (3- chlorophenyl)- 5- [5- (thiophen- 2- yl)pyrazolidin- 3- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Clc1cccc(c1)N1C(=O)NC(=O)/C(=C\2/NNC(C2)c2cccs2)/C1=O

STK574900
Synonyms: 5,6- dimethyl- N- [3- (morpholin- 4- yl)propyl]furo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1c(C)oc2c1c(NCCCN1CCOCC1)ncn2

STK574910
Synonyms: (4E)- 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylimino)- 6- [(4- methylpiperazin- 1- yl)methyl]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: CN1CCN(CC1)Cc1nc(N)n/c(=N/c2ccc3c(c2)OCCO3)/[nH]1

STK574914
Synonyms: 5- (2- hydroxy- 4,5- dimethylphenyl)- N- {4- [methyl(phenyl)sulfamoyl]phenyl}- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1cc(C)c(cc1O)C)Nc1ccc(cc1)S(=O)(=O)N(c1ccccc1)C

STK848308
Synonyms: 3- (4- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- ylcyclopropanecarboxylate
Smiles: COc1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OC(=O)C1CC1

STK574918
Synonyms: 7- (3,5- dimethylphenyl)- 3- (2- methylphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Cc1cc(C)cc(c1)n1ncc2c1ncn1c2nnc1c1ccccc1C

STK574919
Synonyms: 1- [2- (3,4- dimethoxyphenyl)- 10- (furan- 2- yl)- 8- methyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2)OC(=C(C1c1ccco1)C(=O)C)C

STK574920
Synonyms: 6- chloro- 4- {[4- (4- methoxyphenyl)piperazin- 1- yl]methyl}- 7- methyl- 2H- chromen- 2- one
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1cc(=O)oc2c1cc(Cl)c(c2)C

STK574921
Synonyms: (5E)- 5- {[(4- fluorophenyl)amino]methylidene}- 2- hydroxy- 1- phenylpyrimidine- 4,6(1H,5H)- dione
Smiles: Fc1ccc(cc1)N/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1)O

STK574923
Synonyms: 6- amino- 5- bromo- 4- hydroxy- 1- phenylpyrimidin- 2(1H)- one
Smiles: Oc1nc(=O)n(c(c1Br)N)c1ccccc1

STK574925
Synonyms: ethyl4- (8- chloro- 5,6- dihydro- 11H- benzo[5,6]cyclohepta[1,2- b]pyridin- 11- ylidene)piperidine- 1- carboxylate
Smiles: CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1

STK574928
Synonyms: 12- (furan- 2- yl)- 2- (thiophen- 2- yl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: O=C1CCCC2=C1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1cccs1

STK574931
Synonyms: 3- [chloro(phenyl)methyl]quinoxalin- 2- ol
Smiles: Oc1nc2ccccc2nc1C(c1ccccc1)Cl

STK574932
Synonyms: 5- [(4- fluorobenzyl)oxy]- 2- [4- (4- methoxyphenyl)- 3- methyl- 1,2- oxazol- 5- yl]phenol
Smiles: COc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1ccc(cc1)F

STK574936
Synonyms: 4- (4- ethylpiperazin- 1- yl)- 2- phenyl[1]benzofuro[3,2- d]pyrimidine
Smiles: CCN1CCN(CC1)c1nc(nc2c1oc1c2cccc1)c1ccccc1

STK574943
Synonyms: 4- hydroxy- 8- (4- methoxybenzyl)- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: COc1ccc(cc1)Cn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK574945
Synonyms: N- [(2- methylpiperidin- 1- yl)carbonyl]- L- phenylalanine
Smiles: OC(=O)[C@@H](NC(=O)N1CCCCC1C)Cc1ccccc1

STK848313
Synonyms: 5- (furan- 2- ylmethyl)- 3- (2- hydroxyphenyl)- 4- [4- (methylsulfanyl)phenyl]- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CSc1ccc(cc1)C1N(Cc2ccco2)C(=O)c2c1c([nH]n2)c1ccccc1O

STK574953
Synonyms: 2- chloro- N'- {(Z)- [2- hydroxy- 1- (2- methylphenyl)- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}benzohydrazide
Smiles: O=C1N=C(O)N(C(=O)/C/1=C\NNC(=O)c1ccccc1Cl)c1ccccc1C

STK848316
Synonyms: 1- benzyl- N- (2- fluorophenyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: Fc1ccccc1NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK574959
Synonyms: 6- hydroxy- 1',6'- dimethyl- 3- propyl- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4(3H)- dione
Smiles: CCCN1C(=O)N=C(C2(C1=O)CN(C)c1c(C2)cc(cc1)C)O

STK848317
Synonyms: 3- (furan- 2- ylmethyl)- 8- (4- methylphenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)C)Cc1ccco1

STK574962
Synonyms: 2- (1,3- benzothiazol- 2- ylamino)- 6- (propan- 2- yl)pyrimidin- 4- ol
Smiles: Oc1nc(Nc2nc3c(s2)cccc3)nc(c1)C(C)C

STK574964
Synonyms: (2Z)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)- N- phenylethanethioamide
Smiles: COc1cc2/C(=C/C(=S)Nc3ccccc3)/NCCc2cc1OC

STK574966
Synonyms: 2- [(7,7- dimethyl- 2- phenyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl)sulfanyl]- 1- (morpholin- 4- yl)ethanone
Smiles: O=C(N1CCOCC1)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK574972
Synonyms: N- [4- (4- acetylpiperazin- 1- yl)phenyl]- 5- chloro- 1H- indole- 2- carboxamide
Smiles: Clc1ccc2c(c1)cc([nH]2)C(=O)Nc1ccc(cc1)N1CCN(CC1)C(=O)C

STK848321
Synonyms: 4- [(1- methyl- 5- nitro- 1H- benzimidazol- 2- yl)methyl]- N- phenylpiperazine- 1- carboxamide
Smiles: O=C(N1CCN(CC1)Cc1nc2c(n1C)ccc(c2)[N+](=O)[O-])Nc1ccccc1

STK848322
Synonyms: 3- (2- methoxyphenyl)- 2,5- dimethyl- N- [2- (morpholin- 4- yl)ethyl]pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: COc1ccccc1c1c(C)nn2c1nc(C)cc2NCCN1CCOCC1

STK574977
Synonyms: N- (9- ethyl- 9H- carbazol- 3- yl)- 4- hydroxy- 3,6,6- trimethyl- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: CCn1c2ccc(cc2c2c1cccc2)NC(=O)c1oc2c(c1C)C(O)CC(C2)(C)C

STK848326
Synonyms: 5- (2- hydroxyethyl)- 3- (2- hydroxyphenyl)- 4- phenyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(c2ccccc2)c2c(C1=O)n[nH]c2c1ccccc1O

STK574980
Synonyms: 5- (4- ethoxyphenyl)- 4- {(2E)- 2- [(5- methylfuran- 2- yl)methylidene]hydrazinyl}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1N/N=C/c1ccc(o1)C

STK574981
Synonyms: 9- (3,4- dichlorophenyl)- 2- (methylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CSc1nc2n(n1)C(c1ccc(c(c1)Cl)Cl)C1=C(O)CCCC1=N2

STK574984
Synonyms: N- [(1Z)- 1- {1- cyano- 2- [(2- methylpropyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]thiophene- 2- carboxamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cccs1)/C(=O)NCC(C)C

STK574988
Synonyms: 6- chloro- 4- {[4- (2- hydroxyethyl)piperazin- 1- yl]methyl}- 7- methyl- 2H- chromen- 2- one
Smiles: OCCN1CCN(CC1)Cc1cc(=O)oc2c1cc(Cl)c(c2)C

STK574989
Synonyms: 5- (2- hydroxy- 3,4- dimethylphenyl)- N- {4- [(4- methylpyrimidin- 2- yl)sulfamoyl]phenyl}- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccnc(n1)NS(=O)(=O)c1ccc(cc1)NC(=O)c1n[nH]c(c1)c1ccc(c(c1O)C)C

STK574991
Synonyms: 5- hydroxy- 2- [({4- [(Z)- (3- methyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]phenyl}carbonyl)amino]benzoicacid
Smiles: Oc1ccc(c(c1)C(=O)O)NC(=O)c1ccc(cc1)/C=C/1\SC(=S)N(C1=O)C

STK574995
Synonyms: 12- (furan- 2- yl)- 2- (4- methylphenyl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: Cc1ccc(cc1)c1nc2n(n1)cnc1c2C(c2ccco2)C2=C(O1)CCCC2=O

STK574999
Synonyms: 2- [(3- cyano- 6- methyl- 5,6,7,8- tetrahydro- 1,6- naphthyridin- 2- yl)sulfanyl]- N- (3,4- dimethoxyphenyl)acetamide
Smiles: N#Cc1cc2CN(C)CCc2nc1SCC(=O)Nc1ccc(c(c1)OC)OC

STK848327
Synonyms: 2- (azepan- 1- ylcarbonyl)- 1- (3- methoxypropyl)pyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 4(1H)- one
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)N1CCCCCC1

STK575004
Synonyms: 5- (2- hydroxy- 3,4- dimethylphenyl)- N- (pyridin- 4- ylmethyl)- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1O)C)C)NCc1ccncc1

STK575007
Synonyms: 2- chloro- N'- {(Z)- [1- (3- chlorophenyl)- 2- hydroxy- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}benzohydrazide
Smiles: Clc1cccc(c1)N1C(=NC(=O)/C(=C/NNC(=O)c2ccccc2Cl)/C1=O)O

STK575015
Synonyms: 5- [2- (3,4- dimethoxyphenyl)ethyl]- 3- (5- fluoro- 2- hydroxyphenyl)- 4- (4- fluorophenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1OC)CCN1C(=O)c2c(C1c1ccc(cc1)F)c([nH]n2)c1cc(F)ccc1O

STK575027
Synonyms: 2,2'- [(2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- yl)imino]diethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C)CCO

STK575028
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 5- (2- hydroxyethyl)- 4- phenyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1ccccc1)c([nH]n2)c1cc(Cl)c(cc1O)C

STK848331
Synonyms: 3- (2- chlorophenyl)- N- (2- methoxyethyl)- 2,5- dimethylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: COCCNc1cc(C)nc2n1nc(c2c1ccccc1Cl)C

STK575033
Synonyms: 6,7- dimethoxy- N- (3- methoxyphenyl)- 1- methyl- 3,4- dihydroisoquinoline- 2(1H)- carbothioamide
Smiles: COc1cccc(c1)NC(=S)N1CCc2c(C1C)cc(c(c2)OC)OC

STK575036
Synonyms: 4- {[4- (diphenylmethyl)piperazin- 1- yl]methyl}- 6,7- dimethyl- 2H- chromen- 2- one
Smiles: O=c1cc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(o1)cc(c(c2)C)C

STK575038
Synonyms: N- [2- (2- acetyl- 4,5- dimethoxyphenyl)ethyl]- 2,3,5,6- tetramethylbenzenesulfonamide
Smiles: COc1cc(CCNS(=O)(=O)c2c(C)c(C)cc(c2C)C)c(cc1OC)C(=O)C

STK848333
Synonyms: 4- oxo- N- {3- [(tetrahydrofuran- 2- ylmethyl)carbamoyl]- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl}- 4H- chromene- 2- carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)Nc1sc2c(c1C(=O)NCC1CCCO1)CCCC2

STK848335
Synonyms: 3- (2,4- dimethoxyphenyl)- 8- (4- methoxyphenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: COc1ccc(cc1)C1CC(=O)N2C(=C1C#N)SCN(C2)c1ccc(cc1OC)OC

STK575042
Synonyms: 5- tert- butyl- 3- (4- chlorophenyl)- N- (3,5- dimethylphenyl)- 2- methylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Clc1ccc(cc1)c1c(C)nn2c1nc(cc2Nc1cc(C)cc(c1)C)C(C)(C)C

STK575043
Synonyms: 2- [2- amino- 5- phenyl- 6- (trifluoromethyl)pyrimidin- 4- yl]- 5- [(4- methylbenzyl)oxy]phenol
Smiles: Cc1ccc(cc1)COc1ccc(c(c1)O)c1nc(N)nc(c1c1ccccc1)C(F)(F)F

STK575044
Synonyms: 4- [3- (2- methoxyphenyl)- 1,2,4- oxadiazol- 5- yl]- N- (pyridin- 3- ylmethyl)butanamide
Smiles: COc1ccccc1c1noc(n1)CCCC(=O)NCc1cccnc1

STK575049
Synonyms: [(4Z)- 4- (hydroxyimino)- 3,6,6- trimethyl- 4,5,6,7- tetrahydro- 1- benzofuran- 2- yl](morpholin- 4- yl)methanone
Smiles: O/N=C\1/CC(C)(C)Cc2c1c(C)c(o2)C(=O)N1CCOCC1

STK575050
Synonyms: 5- (2- hydroxyphenyl)- N- {3- [(2- methoxyethyl)carbamoyl]- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl}- 1H- pyrazole- 3- carboxamide
Smiles: COCCNC(=O)c1c(NC(=O)c2n[nH]c(c2)c2ccccc2O)sc2c1CCCC2

STK575052
Synonyms: 9- {(E)- [2- (5- phenylthieno[2,3- d]pyrimidin- 4- yl)hydrazinylidene]methyl}- 2,3,6,7- tetrahydro- 1H,5H- pyrido[3,2,1- ij]quinolin- 8- ol
Smiles: Oc1c(/C=N/Nc2ncnc3c2c(cs3)c2ccccc2)cc2c3c1CCCN3CCC2

STK575053
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)Nc1cccc(c1)NC(=O)C)C

STK575055
Synonyms: 3- cyclopentyl- N- [(2Z)- 5,5- dioxido- 3- (2- phenylethyl)tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]propanamide
Smiles: O=C(/N=C/1\SC2C(N1CCc1ccccc1)CS(=O)(=O)C2)CCC1CCCC1

STK848339
Synonyms: ethyl[3- (4- chlorophenyl)- 7- hydroxy- 5- methylpyrazolo[1,5- a]pyrimidin- 6- yl]acetate
Smiles: CCOC(=O)Cc1c(C)nc2n(c1O)ncc2c1ccc(cc1)Cl

STK848340
Synonyms: 1- benzyl- N- (2- methoxy- 5- methylphenyl)- 7- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COc1ccc(cc1NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cc(cc1)C)C

STK848341
Synonyms: 2- chloropyrido[1,2- b][2,4]benzodiazepin- 6(11H)- imine
Smiles: Clc1ccc2=NC(=N)c3c(Cn2c1)cccc3

STK575061
Synonyms: 2- amino- 5- (1,3- benzodioxol- 5- yl)- 6- hydroxy- 8,8- dimethyl- 5,7,8,9- tetrahydropyrimido[4,5- b]quinolin- 4(3H)- one
Smiles: Nc1nc2N=C3CC(C)(C)CC(=C3C(c2c(=O)[nH]1)c1ccc2c(c1)OCO2)O

STK575063
Synonyms: N- [(2Z)- 3- (1,3- benzodioxol- 5- ylmethyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: CC(=O)/N=C/1\SC2C(N1Cc1ccc3c(c1)OCO3)CS(=O)(=O)C2

STK575065
Synonyms: 7- (4- benzylpiperazin- 1- yl)- 3- (2- chlorophenyl)- 5- methylpyrazolo[1,5- a]pyrimidine
Smiles: Cc1cc(N2CCN(CC2)Cc2ccccc2)n2c(n1)c(cn2)c1ccccc1Cl

STK575066
Synonyms: 1- [2- (3,4- dimethoxyphenyl)ethyl]- 9'- fluoro- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trione
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(=O)C2(C1=O)Cc1cccc(c1N1C2CCC1)F

STK575068
Synonyms: 6- [(5,6- dimethylthieno[2,3- d]pyrimidin- 4- yl)amino]hexanoicacid
Smiles: Cc1c(C)sc2c1c(NCCCCCC(=O)O)ncn2

STK575070
Synonyms: (4Z)- 4- [(3- chloro- 4- methylphenyl)imino]- 6- ({4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}methyl)- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Nc1nc(CN2CCN(CC2)c2cccc(c2)C(F)(F)F)[nH]/c(=N/c2ccc(c(c2)Cl)C)/n1

STK848344
Synonyms: 6- methyl- N- {4- [methyl(phenyl)sulfamoyl]phenyl}- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Cc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc1ccc(cc1)S(=O)(=O)N(c1ccccc1)C

STK575077
Synonyms: 2- [(3- benzyl- 4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- cyclopropylacetamide
Smiles: O=C(NC1CC1)COc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1

STK575082
Synonyms: 7- cyclohexyl- N~5~- (tetrahydrofuran- 2- ylmethyl)- 6,7,8,9- tetrahydro- 3H- pyrazolo[3,4- c][2,7]naphthyridine- 1,5- diamine
Smiles: Nc1n[nH]c2c1c1CCN(Cc1c(n2)NCC1CCCO1)C1CCCCC1

STK848345
Synonyms: N- [4- (4- chlorophenyl)- 1,2,5- oxadiazol- 3- yl]- 3- methylbutanamide
Smiles: CC(CC(=O)Nc1nonc1c1ccc(cc1)Cl)C

STK575091
Synonyms: 2- benzyl- 7- chloro- 1- (3- ethoxy- 4- hydroxyphenyl)- 6- methyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cc(ccc1O)C1N(Cc2ccccc2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK575092
Synonyms: N- (2,5- dimethoxyphenyl)- 5- (2- hydroxy- 3,5- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: COc1ccc(c(c1)NC(=O)c1n[nH]c(c1)c1cc(C)cc(c1O)C)OC

STK575093
Synonyms: 1- (3- chlorophenyl)- 7- fluoro- 2- (2- hydroxyethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)Cl)c(=O)c1c(o2)ccc(c1)F

STK848347
Synonyms: 2- {2- [(3,5- diphenylpyrazolo[1,5- a]pyrimidin- 7- yl)amino]ethoxy}ethanol
Smiles: OCCOCCNc1cc(nc2n1ncc2c1ccccc1)c1ccccc1

STK575097
Synonyms: 5- methyl- N- (2- methylpropyl)- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CC(CNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2)C

STK575098
Synonyms: methylN- (azepan- 1- ylcarbonyl)- D- phenylalaninate
Smiles: COC(=O)[C@H](NC(=O)N1CCCCCC1)Cc1ccccc1

STK575100
Synonyms: tert- butyl(3S)- 3- {[(2S)- 3- methyl- 1- oxo- 1- (propylamino)butan- 2- yl]carbamoyl}- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: CCCNC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK575107
Synonyms: N- [(3,4- dimethoxybenzyl)carbamoyl]- L- valine
Smiles: COc1cc(CNC(=O)N[C@H](C(=O)O)C(C)C)ccc1OC

STK575110
Synonyms: 7- methyl- 4- [(4- methylpiperazin- 1- ium- 1- yl)methyl]- 2- oxo- 2H- chromen- 6- olate
Smiles: CN1CC[NH+](CC1)Cc1cc(=O)oc2c1cc([O-])c(c2)C

STK575114
Synonyms: N- (4- phenyl- 1,2,5- oxadiazol- 3- yl)- 3- propoxybenzamide
Smiles: CCCOc1cccc(c1)C(=O)Nc1nonc1c1ccccc1

STK575115
Synonyms: N- (5- hydroxy- 2- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl)- 2- methylbenzamide
Smiles: Oc1cc(NC(=O)c2ccccc2C)n2c(n1)nc(n2)c1ccccc1

STK848348
Synonyms: 1- (3- methoxypropyl)- 9- methyl- N- (3- methylbutyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCCC(C)C

STK575121
Synonyms: 2- methoxy- 1- (1- methyl- 1H- benzimidazol- 2- yl)- 1- phenylethanamine
Smiles: COCC(c1nc2c(n1C)cccc2)(c1ccccc1)N

STK575122
Synonyms: 1- methyl- 2- (piperazin- 1- yl)- 1H- benzimidazole
Smiles: Cn1c(nc2c1cccc2)N1CCNCC1

STK575123
Synonyms: 2- [(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [2- (1H- indol- 3- yl)ethyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2)/C1=O)NCCc1c[nH]c2c1cccc2

STK575131
Synonyms: 5- (2- fluorophenyl)- 4- {[(E)- (3,4,5- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2c2ccccc2F)cc(c1OC)OC

STK575132
Synonyms: 2- (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)- N- (4- methylphenyl)acetamide
Smiles: COc1cc2c(cc1OC)CCN(C2C)CC(=O)Nc1ccc(cc1)C

STK575133
Synonyms: (4Z)- 4- [(4- ethoxyphenyl)imino]- 6- [(4- phenylpiperazin- 1- yl)methyl]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: CCOc1ccc(cc1)/N=c/1\nc(N)nc([nH]1)CN1CCN(CC1)c1ccccc1

STK575137
Synonyms: 12- (4- fluorophenyl)- 3- methyl- 2,3,4,12- tetrahydrobenzimidazo[2,1- b]quinazolin- 1- ol
Smiles: CC1CC(=C2C(=Nc3n(C2c2ccc(cc2)F)c2c(n3)cccc2)C1)O

STK575143
Synonyms: 8- methyl[1,2,4]triazino[4,5- a]indol- 1- ol
Smiles: Cc1ccc2c(c1)cc1n2cnnc1O

STK575145
Synonyms: {[(2Z)- 2- (furan- 2- ylmethylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}aceticacid
Smiles: OC(=O)COc1ccc2c(c1)O/C(=C\c1ccco1)/C2=O

STK848353
Synonyms: 1- (2- chlorobenzyl)- 2- (3,4- dimethoxyphenyl)- 1H- benzimidazole
Smiles: COc1cc(ccc1OC)c1nc2c(n1Cc1ccccc1Cl)cccc2

STK575153
Synonyms: ethyl2- {[(6- chloro- 7- methyl- 4- oxo- 4H- chromen- 2- yl)carbonyl]amino}- 4,5- dimethylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)sc(c1C)C

STK575154
Synonyms: 6- chloro- 4- {[4- (4- methoxyphenyl)piperazin- 1- yl]methyl}- 2H- chromen- 2- one
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1cc(=O)oc2c1cc(Cl)cc2

STK801759
Synonyms: ethyl4- (3- formyl- 4- oxo- 4H- pyrido[1,2- a]pyrimidin- 2- yl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1nc2ccccn2c(=O)c1C=O

STK575157
Synonyms: 8- (2- methoxyphenyl)- 1- methyl- 3- (2- phenylethyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK848354
Synonyms: 8- (4- ethylphenyl)- 3- (2- methoxyethyl)- 1,7- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccc(cc1)CC)C

STK575164
Synonyms: 5- ({[(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]acetyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2)/C1=O)Nc1ccc(c(c1)C(=O)O)O

STK848357
Synonyms: 3- (3- methylphenyl)- 6- oxo- 8- (2,4,5- trimethoxyphenyl)- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1cc(OC)c(cc1OC)OC)c1cccc(c1)C

STK848358
Synonyms: 1- benzyl- N- (2- methoxyethyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCNC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK575167
Synonyms: ethyl1- [(7- methyl- 2- oxo- 2H- chromen- 4- yl)methyl]piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2)C

STK848359
Synonyms: N- benzyl- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]pyridine- 4- carboxamide
Smiles: O=C(N(Cc1cc2ccccc2[nH]c1=O)Cc1ccccc1)c1ccncc1

STK575173
Synonyms: 1- [2- (2- methoxyphenyl)- 10- (4- methoxyphenyl)- 8- methyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: COc1ccc(cc1)C1C(=C(C)Oc2c1c1nc(nn1cn2)c1ccccc1OC)C(=O)C

STK575176
Synonyms: N- [(2E)- 3- (3- methoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]propanamide
Smiles: CCC(=O)/N=C\1/SC2C(N1Cc1cccc(c1)OC)CS(=O)(=O)C2

STK575177
Synonyms: (5E)- 3- cyclopentyl- 5- [(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CC1Oc2c(C1)cc(cc2)/C=C\1/SC(=S)N(C1=O)C1CCCC1

STK575178
Synonyms: N- (2- chlorophenyl)- 5- (2- hydroxy- 3,5- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1cc(C)c(c(c1)c1[nH]nc(c1)C(=O)Nc1ccccc1Cl)O

STK848362
Synonyms: 4- (3,4- dichlorophenyl)- 3- (2- hydroxyphenyl)- 5- [2- (4- methoxyphenyl)ethyl]- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(c(c1)Cl)Cl)c([nH]n2)c1ccccc1O

STK575183
Synonyms: 5- [(3- chlorobenzyl)oxy]- 2- [5- (4- methoxyphenyl)- 6- (trifluoromethyl)pyrimidin- 4- yl]phenol
Smiles: COc1ccc(cc1)c1c(ncnc1C(F)(F)F)c1ccc(cc1O)OCc1cccc(c1)Cl

STK575188
Synonyms: 3- [3- (pyrazin- 2- yl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]benzoicacid
Smiles: OC(=O)c1cccc(c1)n1c(=S)[nH]nc1c1cnccn1

STK575189
Synonyms: 4- chloro- N'- {4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1ccc(cc1)Cl)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK575192
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- ethoxy- N- (4- methylbenzyl)benzamide
Smiles: CCOc1ccccc1C(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)C

STK575195
Synonyms: 5- (2- hydroxy- 5- methylphenyl)- N- {3- [(tetrahydrofuran- 2- ylmethyl)carbamoyl]- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl}- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(c(c1)c1[nH]nc(c1)C(=O)Nc1sc2c(c1C(=O)NCC1CCCO1)CCC2)O

STK848365
Synonyms: 1,3- dimethyl- 8- (4- methylpiperidin- 1- yl)- 7- {2- [(4- methylpyrimidin- 2- yl)sulfanyl]ethyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCN(CC1)c1nc2c(n1CCSc1nccc(n1)C)c(=O)n(c(=O)n2C)C

STK575196
Synonyms: (5E)- 5- (4- fluorobenzylidene)- 2- imino- 1- methyl- 2,5- dihydro- 1H- imidazol- 4- ol
Smiles: CN1C(=N)N=C(/C/1=C\c1ccc(cc1)F)O

STK575197
Synonyms: N- [(2S)- 1- (butylamino)- 4- (methylsulfanyl)- 1- oxobutan- 2- yl]- 1- [(4- methylphenyl)sulfonyl]piperidine- 4- carboxamide
Smiles: CSCC[C@@H](C(=O)NCCCC)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

STK575198
Synonyms: 3,5- diphenyl- N- (propan- 2- yl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CC(Nc1cc(nc2n1ncc2c1ccccc1)c1ccccc1)C

STK575201
Synonyms: 3- butyl- 7- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCn1cnc2c(c1=O)[nH]c1c2ccc(c1)OC

STK848369
Synonyms: N- [(2Z)- 5- ethyl- 4- phenyl- 1,3- thiazol- 2(3H)- ylidene]- 3- (2- oxo- 1,3- benzoxazol- 3(2H)- yl)propanamide
Smiles: CCc1s/c(=N\C(=O)CCn2c(=O)oc3c2cccc3)/[nH]c1c1ccccc1

STK575215
Synonyms: N- [2- (morpholin- 4- yl)ethyl]- 2- phenyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: O1CCN(CC1)CCNc1nc(nc2c1oc1c2cccc1)c1ccccc1

STK575228
Synonyms: 6- amino- 1- (2- chlorobenzyl)- 4- hydroxypyrimidin- 2(1H)- one
Smiles: Oc1cc(N)n(c(=O)n1)Cc1ccccc1Cl

STK848370
Synonyms: 2- amino- 5- (1,3- benzodioxol- 5- yl)- 4- hydroxy- 5,8- dihydropyrido[2,3- d]pyrimidin- 7(6H)- one
Smiles: O=C1Nc2nc(N)nc(c2C(C1)c1ccc2c(c1)OCO2)O

STK575231
Synonyms: 2- hydroxy- 4- ({[(5Z)- 5- (3- methoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]acetyl}amino)benzoicacid
Smiles: COc1cccc(c1)/C=C/1\SC(=S)N(C1=O)CC(=O)Nc1ccc(c(c1)O)C(=O)O

STK575235
Synonyms: 1'- (2- chlorobenzyl)- 1- ethyl- 2- methyl- 2H,2'H,4H- spiro[dipyrido[1,2- a:2',3'- d]pyrimidine- 3,5'- pyrimidine]- 2',4',5,6'(1H,1'H,3'H)- tetrone
Smiles: CCN1c2nc3ccccn3c(=O)c2CC2(C1C)C(=O)NC(=O)N(C2=O)Cc1ccccc1Cl

STK575236
Synonyms: 2- chloro- N'- {(Z)- [1- (3,4- dimethylphenyl)- 2- hydroxy- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}benzohydrazide
Smiles: O=C1N=C(O)N(C(=O)/C/1=C\NNC(=O)c1ccccc1Cl)c1ccc(c(c1)C)C

STK575238
Synonyms: 4- [({[4- (4- methoxyphenyl)- 5- (thiophen- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)O)nnc1c1cccs1

STK575240
Synonyms: 2- [(6- chloro- 2- oxo- 4- phenyl- 2H- chromen- 7- yl)oxy]- N- (pyridin- 3- ylmethyl)acetamide
Smiles: O=C(COc1cc2oc(=O)cc(c2cc1Cl)c1ccccc1)NCc1cccnc1

STK848373
Synonyms: 2- [2- amino- 5- (3,4- dimethoxyphenyl)pyrimidin- 4- yl]- 5- [(2- chloro- 6- fluorobenzyl)oxy]phenol
Smiles: COc1ccc(cc1OC)c1cnc(nc1c1ccc(cc1O)OCc1c(F)cccc1Cl)N

STK575242
Synonyms: 3- (3- chlorophenyl)- 4- ethyl- 5- {[3- (trifluoromethyl)benzyl]sulfanyl}- 4H- 1,2,4- triazole
Smiles: CCn1c(SCc2cccc(c2)C(F)(F)F)nnc1c1cccc(c1)Cl

STK575245
Synonyms: 12- (furan- 2- yl)- 9,9- dimethyl- 2- (pyridin- 2- yl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1ccccn1

STK575246
Synonyms: (5Z)- 5- [5- nitro- 2- (pyrrolidin- 1- yl)benzylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: O=C1NC(=S)S/C/1=C\c1cc(ccc1N1CCCC1)[N+](=O)[O-]

STK575248
Synonyms: methyl3- [(ethylsulfonyl)amino]- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NS(=O)(=O)CC)cc(cc2)F

STK575249
Synonyms: N- [(2E)- 5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- (morpholin- 4- yl)acetamide
Smiles: CCc1n[nH]/c(=N\C(=O)CN2CCOCC2)/s1

STK575250
Synonyms: (1- {2- [(4- ethoxyphenyl)amino]- 2- oxoethyl}piperidinium- 4- yl)(diphenyl)methanolate
Smiles: CCOc1ccc(cc1)NC(=O)C[NH+]1CCC(CC1)C(c1ccccc1)(c1ccccc1)[O-]

STK575251
Synonyms: 4,5,6- trimethoxy- N- (tetrahydrofuran- 2- ylmethyl)- 1H- indole- 2- carboxamide
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)NCC1CCCO1

STK575253
Synonyms: 2- [(2E)- (2,3,4- trimethoxybenzylidene)hydrazinylidene]- 2,3- dihydro- 1H- benzimidazole
Smiles: COc1c(ccc(c1OC)OC)/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK848374
Synonyms: (3- methyl- 6,7- dihydro- 5H- spiro[1- benzofuran- 4,2'- [1,3]dithiolan]- 2- yl)(morpholin- 4- yl)methanone
Smiles: O=C(c1oc2c(c1C)C1(CCC2)SCCS1)N1CCOCC1

STK575254
Synonyms: (2E)- 2- (4- hydroxyquinazolin- 2- yl)- 3- [5- (piperidin- 1- yl)furan- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\c1ccc(o1)N1CCCCC1)/c1nc(O)c2c(n1)cccc2

STK575259
Synonyms: 3- (2- chlorophenyl)- 2,6- dihydroxy- 5- (3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)pyrimidin- 4(3H)- one
Smiles: O=C1OC(c2c1cccc2)c1c(O)nc(n(c1=O)c1ccccc1Cl)O

STK575263
Synonyms: 2- {[4- amino- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK848377
Synonyms: 6- chloro- 4- oxo- N- [(2Z)- 5- (prop- 2- en- 1- ylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4H- chromene- 2- carboxamide
Smiles: C=CCSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)ccc(c3)Cl)/s1

STK575266
Synonyms: 2- benzyl- 8- (4- chlorophenyl)- 11- (furan- 2- yl)- 10- methyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccc(cc1)n1nc(c2c1Oc1ncn3c(c1C2c1ccco1)nc(n3)Cc1ccccc1)C

STK848378
Synonyms: 2- [4- (6,7,8,9- tetrahydro- 5H- [1,2,4]triazolo[4,3- a]azepin- 3- yl)phenyl]- 2,3- dihydro- 1H- isoindol- 1- imine
Smiles: N=C1N(Cc2c1cccc2)c1ccc(cc1)c1nnc2n1CCCCC2

STK848379
Synonyms: 4,7,7- trimethyl- 2,3- dioxo- N- (pyridin- 4- yl)bicyclo[2.2.1]heptane- 1- carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)Nc1ccncc1

STK575273
Synonyms: 11- methyl- N- (pyridin- 3- ylmethyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: O=C(c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2)NCc1cccnc1

STK575279
Synonyms: 4- (3- phenoxyphenyl)- 4,10- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: NC1=NC(n2c(=N1)[nH]c1c2cccc1)c1cccc(c1)Oc1ccccc1

STK575281
Synonyms: 5- [(2- chloro- 4- fluorobenzyl)oxy]- 2- [4- (4- chlorophenyl)- 1H- pyrazol- 5- yl]phenol
Smiles: Clc1ccc(cc1)c1cn[nH]c1c1ccc(cc1O)OCc1ccc(cc1Cl)F

STK575283
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- ethyl- 2- [(5Z)- 5- (2- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]acetamide
Smiles: CCN(C1CCS(=O)(=O)C1)C(=O)CN1C(=S)S/C(=C\c2ccccc2F)/C1=O

STK848380
Synonyms: 1,7- dimethyl- 4- oxo- N- (tetrahydrofuran- 2- ylmethyl)- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)n(c(c1)C(=O)NCC1CCCO1)C

STK575285
Synonyms: 5- methyl- 3- (4- methylphenyl)- 7- [4- (2- methylprop- 2- en- 1- yl)piperazin- 1- yl]pyrazolo[1,5- a]pyrimidine
Smiles: CC(=C)CN1CCN(CC1)c1cc(C)nc2n1ncc2c1ccc(cc1)C

STK575287
Synonyms: 3- amino- 1- (4- methylphenyl)- 1H- [1,3,5]triazino[1,2- a]quinazolin- 6- ol
Smiles: Cc1ccc(cc1)C1N=C(N)N=c2n1c1ccccc1c(n2)O

STK575291
Synonyms: N- [(2E)- 3- (2- chlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)/N=C\1/SC2C(N1c1ccccc1Cl)CS(=O)(=O)C2

STK848381
Synonyms: 8- (2,4- dimethoxyphenyl)- 3- (4- ethylphenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: CCc1ccc(cc1)N1CSC2=C(C#N)C(CC(=O)N2C1)c1ccc(cc1OC)OC

STK575297
Synonyms: N- [(2- fluorobenzyl)carbamoyl]- L- phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)NCc1ccccc1F

STK575305
Synonyms: (3aS,4R,4aS,7aR,8R,8aS)- 6- (4- chlorophenyl)- 3- [(E)- 2- phenylethenyl]- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- epoxy[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1O[C@H]2[C@H]2[C@@H]1ON=C2/C=C/c1ccccc1

STK575311
Synonyms: 2- [(2- methoxyphenoxy)methyl]- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccccc1OCc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK848384
Synonyms: 2- methyl- 3- phenyl- 5- (propan- 2- yl)- 7- (pyrrolidin- 1- yl)pyrazolo[1,5- a]pyrimidine
Smiles: Cc1nn2c(c1c1ccccc1)nc(cc2N1CCCC1)C(C)C

STK575314
Synonyms: 2- (2,4- dichlorophenoxy)- 1- (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)propan- 1- one
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)C(Oc1ccc(cc1Cl)Cl)C

STK575315
Synonyms: (3aR,6aS)- 3- (2,3- dimethoxyphenyl)- 5- (4- fluorophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: COc1cccc(c1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)F

STK848385
Synonyms: (2Z)- N- [2- chloro- 5- (trifluoromethyl)phenyl]- 2- [(2,5- dimethoxyphenyl)imino]- 4- hydroxy- 5,6- dihydro- 2H- 1,3- thiazine- 6- carboxamide
Smiles: COc1ccc(c(c1)/N=C\1/N=C(O)CC(S1)C(=O)Nc1cc(ccc1Cl)C(F)(F)F)OC

STK575324
Synonyms: (4- ethylpiperazin- 1- yl)(6- methoxy- 1H- indol- 2- yl)methanone
Smiles: CCN1CCN(CC1)C(=O)c1cc2c([nH]1)cc(cc2)OC

STK575325
Synonyms: N- (3- hydroxypropyl)- 2- [(6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yl)oxy]acetamide
Smiles: OCCCNC(=O)COc1ccc2c(c1)oc(=O)c1c2CCCC1

STK575328
Synonyms: (3S)- N- {(2S)- 1- [(4- methylbenzyl)amino]- 1- oxopropan- 2- yl}- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C)NCc1ccc(cc1)C

STK575331
Synonyms: 6,7- dichloro- 3- {[2- (diethylamino)ethoxy]carbonyl}- 4- [(dimethylammonio)methyl]- 2- methyl- 1- benzofuran- 5- olate
Smiles: CCN(CCOC(=O)c1c(C)oc2c1c(C[NH+](C)C)c([O-])c(c2Cl)Cl)CC

STK575333
Synonyms: 1- {2- [2- (azepan- 1- yl)ethyl]- 1- methyl- 1H- benzimidazol- 5- yl}- 3- phenylurea
Smiles: O=C(Nc1ccccc1)Nc1ccc2c(c1)nc(n2C)CCN1CCCCCC1

STK575335
Synonyms: 2- [(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [3- (1H- imidazol- 1- yl)propyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2)/C1=O)NCCCn1cncc1

STK848388
Synonyms: (4E)- 4- [hydroxy(phenyl)methylidene]- 5- phenyl- 1- (pyridin- 3- yl)pyrrolidine- 2,3- dione
Smiles: O/C(=C/1\C(c2ccccc2)N(C(=O)C1=O)c1cccnc1)/c1ccccc1

STK848390
Synonyms: 2- (3- hydroxypropyl)- 1'- (prop- 2- en- 1- yl)- 2H- spiro[chromeno[2,3- c]pyrrole- 1,3'- indole]- 2',3,9(1'H)- trione
Smiles: OCCCN1C(=O)c2c(C31C(=O)N(c1c3cccc1)CC=C)c(=O)c1c(o2)cccc1

STK575339
Synonyms: 5- tert- butyl- 3- (4- chlorophenyl)- N- (3- methoxyphenyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: COc1cccc(c1)Nc1cc(nc2n1ncc2c1ccc(cc1)Cl)C(C)(C)C

STK575342
Synonyms: 1- tert- butyl4- (8- methoxy- 6- oxo- 6H- benzo[c]chromen- 3- yl)piperidine- 1,4- dicarboxylate
Smiles: COc1ccc2c(c1)c(=O)oc1c2ccc(c1)OC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK575343
Synonyms: 8- {[(Z)- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)methyl]amino}- 2',6'- dihydroxy- 3- phenyl- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidin]- 4'- one
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(N/C=C\3/C(=NC(=NC3=O)O)O)ccc1N1C2CN(CC1)c1ccccc1

STK575352
Synonyms: 2- [(6- chloro- 4- ethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: CCc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)NCc1ccncc1

STK575355
Synonyms: 2- [(5E)- 5- (3,4- dihydroxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoicacid
Smiles: CCC(N1C(=S)S/C(=C/c2ccc(c(c2)O)O)/C1=O)C(=O)O

STK575356
Synonyms: 5- [(4- ethoxybenzyl)amino]- 2- (morpholin- 4- ium- 4- yl)benzoate
Smiles: CCOc1ccc(cc1)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK575358
Synonyms: 2,6- diamino- 4- [4- (propan- 2- yloxy)phenyl]- 4H- thiopyran- 3,5- dicarbonitrile
Smiles: CC(Oc1ccc(cc1)C1C(=C(N)SC(=C1C#N)N)C#N)C

STK575360
Synonyms: 4- {[(2Z)- 3- (3,5- dimethylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]amino}- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)/N=C/1\SC2C(N1c1cc(C)cc(c1)C)CS(=O)(=O)C2

STK848393
Synonyms: 2- bromopyrido[1,2- b][2,4]benzodiazepin- 6(11H)- imine
Smiles: Brc1ccc2=NC(=N)c3c(Cn2c1)cccc3

STK575364
Synonyms: N- (3- acetylphenyl)- 2- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: CCC(n1cnc2c(c1=O)cccc2)C(=O)Nc1cccc(c1)C(=O)C

STK575365
Synonyms: 5- tert- butyl- 7- (4- cyclohexylpiperazin- 1- yl)- 3- phenylpyrazolo[1,5- a]pyrimidine
Smiles: CC(c1cc(N2CCN(CC2)C2CCCCC2)n2c(n1)c(cn2)c1ccccc1)(C)C

STK575367
Synonyms: 5- [(2E)- 3- (4- chlorophenyl)prop- 2- enoyl]- 2,6- dihydroxy- 3- (prop- 2- en- 1- yl)pyrimidin- 4(3H)- one
Smiles: C=CCn1c(O)nc(c(c1=O)C(=O)/C=C/c1ccc(cc1)Cl)O

STK575368
Synonyms: 7- chloro- 1- (4- fluorophenyl)- 6- methyl- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK575369
Synonyms: 7- hydroxy- 5- (4- hydroxy- 3,5- dimethoxyphenyl)- 2- (prop- 2- en- 1- ylsulfanyl)- 5,6- dihydropyrido[2,3- d]pyrimidin- 4(3H)- one
Smiles: C=CCSc1nc2N=C(O)CC(c2c(=O)[nH]1)c1cc(OC)c(c(c1)OC)O

STK575370
Synonyms: 5- (2- hydroxy- 3,4- dimethylphenyl)- N- (4- methoxybenzyl)- 1H- pyrazole- 3- carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1n[nH]c(c1)c1ccc(c(c1O)C)C

STK575374
Synonyms: 2- [(2,2- dimethyl- 5- propyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- yl)amino]ethanol
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCCO

STK575375
Synonyms: 8- (2- aminophenyl)- 4- hydroxy- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Nc1ccccc1n1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK575379
Synonyms: 5- (2- hydroxy- 3,5- dimethylphenyl)- N- (4- methoxybenzyl)- 1H- pyrazole- 3- carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1n[nH]c(c1)c1cc(C)cc(c1O)C

STK848396
Synonyms: 6- ethyl- 2- {[4- (4- methoxyphenyl)piperazin- 1- yl]carbonyl}- 4H- chromen- 4- one
Smiles: CCc1ccc2c(c1)c(=O)cc(o2)C(=O)N1CCN(CC1)c1ccc(cc1)OC

STK575381
Synonyms: 5- [(2- fluorobenzyl)oxy]- 2- (3- methyl- 4- phenyl- 1,2- oxazol- 5- yl)phenol
Smiles: Oc1cc(ccc1c1onc(c1c1ccccc1)C)OCc1ccccc1F

STK848397
Synonyms: N- [4- chloro- 3- (trifluoromethyl)phenyl]- 1- (3- methylphenyl)- 4- oxo- 1,4- dihydropyridazine- 3- carboxamide
Smiles: Cc1cccc(c1)n1ccc(=O)c(n1)C(=O)Nc1ccc(c(c1)C(F)(F)F)Cl

STK848398
Synonyms: (4E)- 5- (2,4- dimethoxyphenyl)- 4- [hydroxy(phenyl)methylidene]- 1- phenylpyrrolidine- 2,3- dione
Smiles: COc1ccc(c(c1)OC)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccccc1

STK575387
Synonyms: 2- [(3,4- dimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: O=C(NCc1ccncc1)COc1ccc2c(c1)oc(=O)c(c2C)C

STK575389
Synonyms: (5Z)- 3- {2- [2- (2- hydroxyethyl)piperidin- 1- yl]- 2- oxoethyl}- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: OCCC1CCCCN1C(=O)CN1C(=S)S/C(=C\c2cccs2)/C1=O

STK848399
Synonyms: 7- [(3- chlorobenzyl)oxy]- 3- (3,4- dimethoxyphenyl)- 4H- chromen- 4- one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc(c2)OCc1cccc(c1)Cl

STK848400
Synonyms: 5- methoxy- 2- [4- (4- methoxyphenyl)- 3- methyl- 1H- pyrazol- 5- yl]phenol
Smiles: COc1ccc(cc1)c1c(C)n[nH]c1c1ccc(cc1O)OC

STK575391
Synonyms: 3- (2- hydroxy- 3,5- dimethylphenyl)- 4- (3- hydroxyphenyl)- 5- (3- methoxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COCCCN1C(=O)c2c(C1c1cccc(c1)O)c([nH]n2)c1cc(C)cc(c1O)C

STK575397
Synonyms: N- [3- ({2- [4- (propan- 2- yloxy)phenyl]quinazolin- 4- yl}oxy)phenyl]acetamide
Smiles: CC(=O)Nc1cccc(c1)Oc1nc(nc2c1cccc2)c1ccc(cc1)OC(C)C

STK575403
Synonyms: 2- (1,3- benzoxazol- 2- ylamino)- 4- (3- methoxyphenyl)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinazolin- 5- ol
Smiles: COc1cccc(c1)C1N=C(Nc2nc3c(o2)cccc3)N=C2C1=C(O)CC(C2)(C)C

STK848403
Synonyms: 4- (2- fluorophenyl)- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1c1ccccc1F

STK575408
Synonyms: 8- [(3,5- dimethylpiperidin- 1- yl)methyl]- 1,3- dimethyl- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(CN2CC(C)CC(C2)C)nc2c1c(=O)n(c(=O)n2C)C

STK848404
Synonyms: (6E)- 7- imino- 2- methyl- 6- [(5- phenylfuran- 2- yl)methylidene]- 6,7- dihydro- 5H- [1,2]oxazolo[2,3- a]pyrimidin- 5- one
Smiles: Cc1on2c(=NC(=O)/C(=C/c3ccc(o3)c3ccccc3)/C2=N)c1

STK575409
Synonyms: 2- [(7- methyl- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 9- yl)oxy]- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)COc1cc(C)cc2c1c1CCCc1c(=O)o2

STK575413
Synonyms: 7- chloro- 1- (3- ethoxy- 4- hydroxyphenyl)- 6- methyl- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cc(ccc1O)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK575414
Synonyms: 9- (4- ethylpiperazin- 1- yl)- 2- methyl- 3- phenyl- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazoline
Smiles: CCN1CCN(CC1)c1c2CCCCc2nc2n1nc(c2c1ccccc1)C

STK575417
Synonyms: 5- (4- chlorophenyl)- 3- [2- (diethylamino)ethyl]- 4- imino- 3,5- dihydro- 4H- chromeno[2,3- d]pyrimidin- 8- ol
Smiles: CCN(CCn1cnc2c(c1=N)C(c1ccc(cc1)Cl)c1c(O2)cc(cc1)O)CC

STK575418
Synonyms: 5,6- dimethyl- N- [3- (trifluoromethyl)phenyl]furo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1oc2c(c1C)c(ncn2)Nc1cccc(c1)C(F)(F)F

STK575422
Synonyms: 1- (3- hydroxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Oc1cccc(c1)C1NC(=O)c2c1c(=O)c1c(o2)cccc1

STK575424
Synonyms: (5Z)- 5- (2,3- dimethoxybenzylidene)- 2- imino- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: COc1c(/C=C/2\SC(=N)N=C2O)cccc1OC

STK575426
Synonyms: 7- (furan- 2- yl)- 2- hydroxy- N- (4- methylphenyl)- 5- oxo- 3,4,5,6,7,8- hexahydroquinoline- 4- carboxamide
Smiles: OC1=NC2=C(C(C1)C(=O)Nc1ccc(cc1)C)C(=O)CC(C2)c1ccco1

STK575427
Synonyms: (E)- 1- (2- methoxyphenyl)- N- (9,10,11,12- tetrahydro- 8H- cyclohepta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- ylmethoxy)methanimine
Smiles: COc1ccccc1/C=N/OCc1nc2n(n1)cnc1c2c2CCCCCc2s1

STK575432
Synonyms: 7- (2- chloro- 6- fluorobenzyl)- 6- hydroxy- 3- methyl- 8- [(4- methylpiperazin- 1- yl)methyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: CN1CCN(CC1)Cc1nc2c(n1Cc1c(F)cccc1Cl)c(O)nc(=O)n2C

STK575436
Synonyms: 2- [4- (4- chlorophenyl)- 3- methyl- 1,2- oxazol- 5- yl]- 5- [(4- nitrobenzyl)oxy]phenol
Smiles: Clc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1ccc(cc1)[N+](=O)[O-]

STK575437
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)c1cc2c(n1C)ccc(c2)Cl)C

STK848409
Synonyms: 2- ethyl- N- [2- (morpholin- 4- yl)ethyl][1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: CCc1nc(NCCN2CCOCC2)c2c(n1)c1ccccc1o2

STK575442
Synonyms: N,N- dimethyl- N'- (2- methyl- 3,5- diphenylpyrazolo[1,5- a]pyrimidin- 7- yl)ethane- 1,2- diamine
Smiles: CN(CCNc1cc(nc2n1nc(c2c1ccccc1)C)c1ccccc1)C

STK575445
Synonyms: 9- hydroxy- 7- (morpholin- 4- yl)- 6,8- diazaspiro[4.5]deca- 6,8- diene- 10- carbonitrile
Smiles: N#CC1C(=NC(=NC21CCCC2)N1CCOCC1)O

STK575458
Synonyms: 8- (ethylsulfanyl)- 6- hydroxy- 3- methyl- 7- (2- methylprop- 2- en- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCSc1nc2c(n1CC(=C)C)c(O)nc(=O)n2C

STK575466
Synonyms: 2- [2- amino- 5- (4- chlorophenyl)- 6- (trifluoromethyl)pyrimidin- 4- yl]- 5- [(4- methylbenzyl)oxy]phenol
Smiles: Nc1nc(c2ccc(cc2O)OCc2ccc(cc2)C)c(c(n1)C(F)(F)F)c1ccc(cc1)Cl

STK575467
Synonyms: N- (3- methyl- 1- oxo- 1- {[3- (1H- tetrazol- 1- yl)phenyl]amino}butan- 2- yl)benzamide
Smiles: CC(C(C(=O)Nc1cccc(c1)n1cnnn1)NC(=O)c1ccccc1)C

STK575469
Synonyms: 1- {3- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]propanoyl}piperidine- 4- carboxylicacid
Smiles: O=C(N1CCC(CC1)C(=O)O)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK575470
Synonyms: 6- ethyl- 6- methyl- 2- (methylsulfanyl)- 4- (piperidin- 1- yl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(nc1N1CCCCC1)SC

STK848413
Synonyms: 5- methoxy- 2- [5- (2- methoxyphenyl)pyrimidin- 4- yl]phenol
Smiles: COc1ccc(c(c1)O)c1ncncc1c1ccccc1OC

STK575471
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (2- fluorophenyl)- 5- [2- (4- methoxyphenyl)ethyl]- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccccc1F)c([nH]n2)c1cc(Cl)c(cc1O)C

STK575472
Synonyms: 2- (7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- [2- (4- sulfamoylphenyl)ethyl]acetamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)NCCc1ccc(cc1)S(=O)(=O)N

STK575477
Synonyms: 3- [(2E)- 2- (5- cyano- 6- hydroxy- 4- methyl- 2- oxopyridin- 3(2H)- ylidene)hydrazinyl]benzoicacid
Smiles: N#CC1=C(C)/C(=N\Nc2cccc(c2)C(=O)O)/C(=O)N=C1O

STK848414
Synonyms: 1- (1H- imidazol- 1- yl)- 3- propylpyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCCc1cc(n2cncc2)n2c(c1C#N)nc1c2cccc1

STK575479
Synonyms: 5- [(2,5- dimethylbenzyl)oxy]- 2- [4- (3- methoxyphenoxy)- 3- methyl- 1H- pyrazol- 5- yl]phenol
Smiles: COc1cccc(c1)Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1cc(C)ccc1C

STK575481
Synonyms: 6- [2- (azepan- 1- yl)- 2- oxoethyl]- 9- fluoro- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 5(6H)- one
Smiles: Fc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2CC(=O)N1CCCCCC1

STK575482
Synonyms: 3- (7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (4- sulfamoylbenzyl)propanamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NCc1ccc(cc1)S(=O)(=O)N

STK575484
Synonyms: 5- (4- chlorophenyl)- 4- imino- 3- (2- methylpropyl)- 3,5- dihydro- 4H- chromeno[2,3- d]pyrimidin- 8- ol
Smiles: Clc1ccc(cc1)C1c2ccc(cc2Oc2c1c(=N)n(cn2)CC(C)C)O

STK575486
Synonyms: N- (2,5- dimethoxyphenyl)- 5- (2- hydroxy- 4- methylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: COc1ccc(cc1NC(=O)c1n[nH]c(c1)c1ccc(cc1O)C)OC

STK575491
Synonyms: 2- [2- amino- 5- (4- methoxyphenyl)pyrimidin- 4- yl]- 5- [(2,6- dichlorobenzyl)oxy]phenol
Smiles: COc1ccc(cc1)c1cnc(nc1c1ccc(cc1O)OCc1c(Cl)cccc1Cl)N

STK575493
Synonyms: methylN- [(5- hydroxypentyl)carbamoyl]- D- alaninate
Smiles: C[C@H](C(=O)OC)NC(=O)NCCCCCO

STK575495
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK848415
Synonyms: 3- [2- oxo- 2- (pyrrolidin- 1- yl)ethyl]- 7,8,9,10- tetrahydropyrimido[4',5':4,5]furo[2,3- b]quinolin- 4(3H)- one
Smiles: O=C(N1CCCC1)Cn1cnc2c(c1=O)oc1c2cc2c(n1)CCCC2

STK575498
Synonyms:
Smiles: CCC([C@@H](c1nnc(o1)SCC(=O)Nc1ccccc1CC)N)C

STK575501
Synonyms: N- {[2- (4- chlorophenyl)ethyl]carbamoyl}- L- alanine
Smiles: C[C@@H](C(=O)O)NC(=O)NCCc1ccc(cc1)Cl

STK575503
Synonyms: (3R)- 2,2- dimethyl- 5- oxo- N- [(2S)- 1- oxo- 1- (pentylamino)propan- 2- yl]- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: CCCCCNC(=O)[C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C

STK575504
Synonyms: 1- ethyl- 1',2,3',10- tetramethyl- 2H,2'H,4H- spiro[dipyrido[1,2- a:2',3'- d]pyrimidine- 3,5'- pyrimidine]- 2',4',5,6'(1H,1'H,3'H)- tetrone
Smiles: CCN1c2nc3c(C)cccn3c(=O)c2CC2(C1C)C(=O)N(C)C(=O)N(C2=O)C

STK575505
Synonyms: 5- [(2- ethoxy- 3- methoxybenzyl)amino]- 2- (morpholin- 4- ium- 4- yl)benzoate
Smiles: CCOc1c(cccc1OC)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK575521
Synonyms: 3- [(5Z)- 5- (4- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [(2R)- 1- hydroxy- 3- phenylpropan- 2- yl]propanamide
Smiles: OCC(Cc1ccccc1)NC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)F)/C1=O

STK848421
Synonyms: 3- (2- methoxyphenyl)- 5- methyl- 7- (morpholin- 4- yl)pyrazolo[1,5- a]pyrimidine
Smiles: COc1ccccc1c1cnn2c1nc(C)cc2N1CCOCC1

STK575522
Synonyms: 5- benzyl- 4,6- dihydroxy- 1- (2- methylphenyl)pyrimidin- 2(1H)- one
Smiles: Cc1ccccc1n1c(=O)nc(c(c1O)Cc1ccccc1)O

STK575524
Synonyms: 1- [bis(2- methoxyethyl)amino]- 3- methylpyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: COCCN(c1cc(C)c(c2n1c1ccccc1n2)C#N)CCOC

STK575526
Synonyms: N- (5- benzyl- 1,3- thiazol- 2- yl)- 3- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1ncc(s1)Cc1ccccc1)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK848423
Synonyms: 2- (2- fluorophenoxy)- N- [4- (4- methylphenyl)- 1,2,5- oxadiazol- 3- yl]butanamide
Smiles: CCC(C(=O)Nc1nonc1c1ccc(cc1)C)Oc1ccccc1F

STK575527
Synonyms: 1- hydroxyisoquinolin- 5- ylbenzoate
Smiles: O=C(c1ccccc1)Oc1cccc2c1ccnc2O

STK848424
Synonyms: N- (4- butylphenyl)- 1- (3- methoxypropyl)- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: CCCCc1ccc(cc1)NC(=O)c1cc2c(n1CCCOC)nc1n(c2=O)cccc1C

STK575531
Synonyms: 4- [(2- methylpiperidin- 1- yl)methyl]- 7,8- dihydrocyclopenta[g]chromen- 2(6H)- one
Smiles: CC1CCCCN1Cc1cc(=O)oc2c1cc1CCCc1c2

STK575532
Synonyms: 2- [2- amino- 5- (4- methoxyphenyl)- 6- (trifluoromethyl)pyrimidin- 4- yl]- 5- [(4- ethenylbenzyl)oxy]phenol
Smiles: COc1ccc(cc1)c1c(nc(nc1C(F)(F)F)N)c1ccc(cc1O)OCc1ccc(cc1)C=C

STK575534
Synonyms: 6- ethyl- 2- oxo- 4- ({4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- ium- 1- yl}methyl)- 2H- chromen- 7- olate
Smiles: CCc1cc2c(cc1[O-])oc(=O)cc2C[NH+]1CCN(CC1)C/C=C/c1ccccc1

STK848426
Synonyms: 1,7- dimethyl- N- (2- methylpropyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: CC(CNC(=O)c1cc2c(n1C)nc1n(c2=O)cc(cc1)C)C

STK575538
Synonyms: N- benzyl- 2- (6- hydroxy- 3- methyl- 2- oxo- 2,3- dihydro- 7H- purin- 7- yl)acetamide
Smiles: O=C(Cn1cnc2c1c(O)nc(=O)n2C)NCc1ccccc1

STK848427
Synonyms: N- (3,4- dimethylphenyl)- N'- {[4- (4- methoxyphenyl)tetrahydro- 2H- pyran- 4- yl]methyl}ethanediamide
Smiles: COc1ccc(cc1)C1(CCOCC1)CNC(=O)C(=O)Nc1ccc(c(c1)C)C

STK575539
Synonyms: N,N- diethyl- 4- (2- imino- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 3(2H)- yl)- 3- methylaniline
Smiles: CCN(c1ccc(c(c1)C)N1C(=N)SC2C1CS(=O)(=O)C2)CC

STK575540
Synonyms: (5Z)- 5- (furan- 2- ylmethylidene)- 3- {2- oxo- 2- [2- (pyridin- 3- yl)piperidin- 1- yl]ethyl}- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2ccco2)/C(=O)N1CC(=O)N1CCCCC1c1cccnc1

STK575545
Synonyms: 6- hydroxy- 8- (4- methoxyphenyl)- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: COc1ccc(cc1)c1[nH]c2c(n1)n(C)c(=O)nc2O

STK575551
Synonyms: 7,9- di(thiophen- 2- yl)thieno[2,3- b:4,5- b']dipyridine- 2,4- diol
Smiles: Oc1cc(O)c2c(n1)c1c(s2)nc(cc1c1cccs1)c1cccs1

STK575553
Synonyms: 5- tert- butyl- 3- (4- chlorophenyl)- 7- (4- methylpiperidin- 1- yl)pyrazolo[1,5- a]pyrimidine
Smiles: CC1CCN(CC1)c1cc(nc2n1ncc2c1ccc(cc1)Cl)C(C)(C)C

STK848429
Synonyms: 4- (2- fluorophenyl)- 3- (2- hydroxyphenyl)- 5- (3- methoxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COCCCN1C(=O)c2c(C1c1ccccc1F)c([nH]n2)c1ccccc1O

STK575554
Synonyms: 2'- hydroxy- 1',3- dimethyl- 8- nitro- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)C)O

STK575556
Synonyms: 6- chloro- 4- {[4- (3- chlorophenyl)piperazin- 1- yl]methyl}- 2H- chromen- 2- one
Smiles: Clc1cccc(c1)N1CCN(CC1)Cc1cc(=O)oc2c1cc(Cl)cc2

STK575558
Synonyms: 9- [5- (2- chlorophenyl)furan- 2- yl]- 6,6- dimethyl- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8(4H)- one
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccc(o1)c1ccccc1Cl)n1c(N2)ncn1

STK848431
Synonyms: N- [4- (4- methoxyphenyl)- 1,2,5- oxadiazol- 3- yl]butanamide
Smiles: CCCC(=O)Nc1nonc1c1ccc(cc1)OC

STK575561
Synonyms: 5,5- diethyl- 2- (morpholin- 4- ylmethyl)- 5,6- dihydrobenzo[h]quinazolin- 4- ol
Smiles: CCC1(CC)Cc2ccccc2c2c1c(O)nc(n2)CN1CCOCC1

STK575562
Synonyms: (3a'S,6a'R)- 5'- (butan- 2- yl)- 3'- (4- hydroxybenzyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cccc2)C

STK575563
Synonyms: 4- hydroxy- 3,6,6- trimethyl- N- (2,2,6,6- tetramethylpiperidin- 4- yl)- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O=C(c1oc2c(c1C)C(O)CC(C2)(C)C)NC1CC(C)(C)NC(C1)(C)C

STK575564
Synonyms: 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- [2- (4- methoxyphenyl)ethyl]- 4- [4- (propan- 2- yl)phenyl]- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(cc1)C(C)C)c([nH]n2)c1cc(C)cc(c1O)C

STK848432
Synonyms: 2- {4- [5- methyl- 3- phenyl- 2- (trifluoromethyl)pyrazolo[1,5- a]pyrimidin- 7- yl]piperazin- 1- yl}ethanol
Smiles: OCCN1CCN(CC1)c1cc(C)nc2n1nc(c2c1ccccc1)C(F)(F)F

STK575566
Synonyms: S- benzyl- N- [(6'- methyl- 8'- oxo- 3',4'- dihydro- 8'H- spiro[cyclohexane- 1,2'- pyrano[3,2- g]chromen]- 7'- yl)acetyl]- L- cysteine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2)N[C@H](C(=O)O)CSCc1ccccc1

STK575567
Synonyms: 11- (2- methoxyphenyl)- 10- methyl- 8- phenyl- 2- (pyridin- 3- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1cccnc1)c1ccccc1

STK575571
Synonyms: 3- [(4- chlorophenyl)sulfonyl]- 1- (3- ethoxypropyl)- 2- imino- 8- methyl- 1,2- dihydro- 5H- dipyrido[1,2- a:2',3'- d]pyrimidin- 5- one
Smiles: CCOCCCn1c2nc3ccc(cn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccc(cc1)Cl)C

STK575576
Synonyms: 6- {[(4- chlorophenyl)sulfanyl]methyl}- 2- (morpholin- 4- yl)pyrimidin- 4- ol
Smiles: Clc1ccc(cc1)SCc1cc(O)nc(n1)N1CCOCC1

STK575580
Synonyms: ethyl3- {[(5- chlorothiophen- 2- yl)sulfonyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NS(=O)(=O)c1ccc(s1)Cl)cc(cc2)OC

STK575582
Synonyms: 7'- {(E)- [1- (butan- 2- yl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trione
Smiles: CCC(N1C(=NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)S)C

STK575588
Synonyms: N- [(7- hydroxy- 4,8- dimethyl- 2- oxo- 2H- chromen- 3- yl)acetyl]- S- methyl- L- cysteine
Smiles: CSC[C@@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)O

STK575589
Synonyms: N- [4- (azepan- 1- ylsulfonyl)phenyl]- 5- (2- hydroxy- 4,5- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1cc(C)c(cc1O)C)Nc1ccc(cc1)S(=O)(=O)N1CCCCCC1

STK848434
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2,8,10- trimethylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidin- 4- amine
Smiles: COc1cc(CCNc2cc(C)nc3n2nc2c3c(C)cc(n2)C)ccc1OC

STK575595
Synonyms: 2- {1- [1- (2,6- dimethylphenyl)- 1H- tetrazol- 5- yl]cyclohexyl}- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylicacid
Smiles: OC(=O)C1C2C=CC3(C1C(=O)N(C3)C1(CCCCC1)c1nnnn1c1c(C)cccc1C)O2

STK575596
Synonyms: (5E)- 3- cyclohexyl- 6- hydroxy- 5- (2,3,6,7- tetrahydro- 1H,5H- pyrido[3,2,1- ij]quinolin- 9- ylmethylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/c1cc2CCCN3c2c(c1)CCC3)C1CCCCC1

STK575597
Synonyms: 8- (2- methoxy- 5- methylphenyl)- 1,3,6,7- tetramethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1ccc(cc1n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)C)C

STK848435
Synonyms: {[3- (4- bromophenyl)- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- yl]oxy}acetonitrile
Smiles: N#CCOc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Br)C(F)(F)F

STK848436
Synonyms: 2- [5- (3,4- dimethoxyphenyl)pyrimidin- 4- yl]- 5- [(2- fluorobenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cncnc1c1ccc(cc1O)OCc1ccccc1F

STK575605
Synonyms: 3- [3- (1H- imidazol- 1- yl)propyl]- 8- methoxy- 5- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1n2C)CCCn1cncc1

STK575609
Synonyms: 7- (4- bromophenyl)- 5- phenyl- 3,7- dihydrotetrazolo[1,5- a]pyrimidine
Smiles: Brc1ccc(cc1)C1C=C(N=c2n1nn[nH]2)c1ccccc1

STK575613
Synonyms: 2- (2- chlorophenyl)- 9- methyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1ccccc1Cl

STK575614
Synonyms: 4- ({[(5Z)- 5- (4- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]acetyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(CN1C(=S)S/C(=C\c2ccc(cc2)Cl)/C1=O)Nc1ccc(c(c1)O)C(=O)O

STK575615
Synonyms: N- benzyl- 5- (2- hydroxy- 3,4- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1O)C)C)NCc1ccccc1

STK575616
Synonyms: N- [3- (1H- indol- 3- yl)propanoyl]serine
Smiles: OCC(C(=O)O)NC(=O)CCc1c[nH]c2c1cccc2

STK575617
Synonyms: 4- (4- ethylphenyl)- 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- (pyridin- 3- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C

STK575619
Synonyms: 4- (3- bromo- 4- hydroxy- 5- methoxyphenyl)- 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 5- (3- hydroxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1cc(Br)c(c(c1)OC)O)c([nH]n2)c1cc(Cl)c(cc1O)C

STK848437
Synonyms: N- (1,3- benzodioxol- 5- yl)- 1- benzyl- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: O=C(c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C)Nc1ccc2c(c1)OCO2

STK575623
Synonyms: 1- benzyl- 9- methyl- 4- oxo- N- propyl- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: CCCNC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C

STK575624
Synonyms: 4- tert- butyl- N- [(2Z)- 5- [(4- chlorobenzyl)sulfonyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: Clc1ccc(cc1)CS(=O)(=O)c1n[nH]/c(=N/C(=O)c2ccc(cc2)C(C)(C)C)/s1

STK575627
Synonyms: 5- (5- chloro- 2- hydroxyphenyl)- N- (4- methoxybenzyl)- 1H- pyrazole- 3- carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1n[nH]c(c1)c1cc(Cl)ccc1O

STK575628
Synonyms: 2- [(4- ethyl- 8- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 2- ylmethyl)acetamide
Smiles: CCc1cc(=O)oc2c1ccc(c2C)OCC(=O)NCc1ccccn1

STK575630
Synonyms: N- (furan- 2- ylmethyl)- 5,6- dimethoxy- 1H- indole- 2- carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)NCc1ccco1

STK575634
Synonyms: 5- {(2E)- 3- [4- (diethylamino)phenyl]prop- 2- enoyl}- 6- hydroxy- 1,3- dimethylpyrimidine- 2,4(1H,3H)- dione
Smiles: CCN(c1ccc(cc1)/C=C/C(=O)c1c(O)n(C)c(=O)n(c1=O)C)CC

STK575635
Synonyms: 7- (4- chlorophenyl)- 2- (thiophen- 2- yl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccc(cc1)n1ncc2c1ncn1c2nc(n1)c1cccs1

STK575637
Synonyms: N- (2- chlorobenzyl)- 1,7- dimethyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)n(c(c1)C(=O)NCc1ccccc1Cl)C

STK575639
Synonyms: 4- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 2,8,10- trimethylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidine
Smiles: Cc1cc(C)c2c(n1)nn1c2nc(cc1n1nc(cc1C)C)C

STK848443
Synonyms: N- benzyl- 6- ethyl- 2- methylthieno[2,3- d]pyrimidin- 4- amine
Smiles: CCc1sc2c(c1)c(NCc1ccccc1)nc(n2)C

STK575648
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 5- (2- hydroxyethyl)- 4- (3- methoxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)OC)c([nH]n2)c1cc(Cl)c(cc1O)C

STK575651
Synonyms: 4- {[(2,4- dioxo- 1,3- thiazolidin- 5- yl)acetyl]amino}- 2- hydroxybenzoicacid
Smiles: O=C(CC1SC(=O)NC1=O)Nc1ccc(c(c1)O)C(=O)O

STK575652
Synonyms: (3Z)- 1- (2,6- dichlorophenyl)- 3- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)propan- 2- one
Smiles: COc1cc2/C(=C/C(=O)Cc3c(Cl)cccc3Cl)/NCCc2cc1OC

STK575654
Synonyms: (3R)- 2,2- dimethyl- 5- oxo- N- [(2S)- 1- oxo- 1- (piperidin- 1- yl)propan- 2- yl]- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C)N1CCCCC1

STK848447
Synonyms: N- benzyl- 3- (2- methoxyphenyl)- 5- methylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: COc1ccccc1c1cnn2c1nc(C)cc2NCc1ccccc1

STK575655
Synonyms: 2- [(3- benzyl- 4,7- dimethyl- 2- oxo- 2H- chromen- 5- yl)oxy]- N- (pyridin- 4- ylmethyl)propanamide
Smiles: Cc1cc(OC(C(=O)NCc2ccncc2)C)c2c(c1)oc(=O)c(c2C)Cc1ccccc1

STK575660
Synonyms: 1- benzyl- N- (3- methylbutyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: CC(CCNC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1)C

STK575662
Synonyms: 7,8- dihydroxy- 4- {[4- (2- methoxyphenyl)piperazin- 1- yl]methyl}- 2H- chromen- 2- one
Smiles: COc1ccccc1N1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2O)O

STK848449
Synonyms: 5- tert- butyl- 2- methyl- N- (4- methylphenyl)- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1ccc(cc1)Nc1cc(nc2n1nc(c2c1ccccc1)C)C(C)(C)C

STK575670
Synonyms: 2- (4- acetylphenyl)- 4- (phenylcarbonyl)hexahydropyrrolo[3,4- a]pyrrolizine- 1,3(2H,4H)- dione
Smiles: O=C1N(c2ccc(cc2)C(=O)C)C(=O)C2C1C(N1C2CCC1)C(=O)c1ccccc1

STK575672
Synonyms: 2- chloro- 3- [(E)- (1,3- dihydro- 2H- benzimidazol- 2- ylidenehydrazinylidene)methyl]quinoline
Smiles: Clc1nc2ccccc2cc1/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK575674
Synonyms: 4- {[(E)- (2,5- dimethoxyphenyl)methylidene]amino}- 5- (4- fluorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F)OC

STK575675
Synonyms: 6- hydroxy- 3- methyl- 7- (propan- 2- yl)- 8- (pyrrolidin- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: Oc1nc(=O)n(c2c1n(C(C)C)c(n2)N1CCCC1)C

STK575677
Synonyms: methyl4- [(3- {4- [(2- chlorobenzyl)oxy]- 2- hydroxyphenyl}- 1H- pyrazol- 4- yl)oxy]benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1c[nH]nc1c1ccc(cc1O)OCc1ccccc1Cl

STK575679
Synonyms: 4- (3- methoxyphenyl)- 3,4,5,6- tetrahydrobenzo[h]quinazoline- 2- thiol
Smiles: COc1cccc(c1)C1NC(=NC2=C1CCc1c2cccc1)S

STK575687
Synonyms: propan- 2- ylN- [(1,9- dimethyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 2- yl)carbonyl]glycinate
Smiles: CC(OC(=O)CNC(=O)c1cc2c(n1C)nc1n(c2=O)cccc1C)C

STK575688
Synonyms: ethyl4- ({7- [(2- chloro- 6- fluorobenzyl)oxy]- 4- oxo- 4H- chromen- 3- yl}oxy)benzoate
Smiles: CCOC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OCc1c(F)cccc1Cl

STK848452
Synonyms: 2- (3- methyl- 4- phenyl- 1,2- oxazol- 5- yl)- 5- [(2- methylprop- 2- en- 1- yl)oxy]phenol
Smiles: CC(=C)COc1ccc(c(c1)O)c1onc(c1c1ccccc1)C

STK848453
Synonyms: 3- (2,4- dimethoxyphenyl)- 8- (3- methoxyphenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: COc1ccc(c(c1)OC)N1CSC2=C(C#N)C(CC(=O)N2C1)c1cccc(c1)OC

STK575693
Synonyms: 2- [4- (2- bromophenoxy)- 1H- pyrazol- 5- yl]- 5- [(2- fluorobenzyl)oxy]phenol
Smiles: Fc1ccccc1COc1ccc(c(c1)O)c1[nH]ncc1Oc1ccccc1Br

STK848454
Synonyms: 2- methyl- N- [(5Z)- 4- oxo- 5- (2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: S=C1S/C(=C/2\C(=O)Nc3c2cccc3)/C(=O)N1NC(=O)c1ccccc1C

STK575711
Synonyms: (4E)- 4- {[(1,1- dioxidotetrahydrothiophen- 3- yl)amino]methylidene}- 2- (2- methylphenyl)isoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1/C(=C/NC2CCS(=O)(=O)C2)/c2ccccc2C(=O)N1c1ccccc1C

STK575713
Synonyms: 2- {[4- amino- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- phenoxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK575714
Synonyms: 2- amino- 4- (2- chlorophenyl)- 5- hydroxy- 4H- pyrano[3,2- c]quinoline- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1Cl)c(O)nc1c2cccc1

STK848456
Synonyms: (2Z)- 6- (benzyloxy)- 2- (pyridin- 4- ylmethylidene)- 1- benzofuran- 3(2H)- one
Smiles: O=C1/C(=C/c2ccncc2)/Oc2c1ccc(c2)OCc1ccccc1

STK575717
Synonyms: (4E)- 2- (2,3- dichlorophenyl)- 4- {[(1,1- dioxidotetrahydrothiophen- 3- yl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1/C(=C/NC2CCS(=O)(=O)C2)/c2ccccc2C(=O)N1c1cccc(c1Cl)Cl

STK575721
Synonyms: {2- [(5- fluoro- 3- hydroxy- 2- oxo- 2,3- dihydro- 1H- indol- 3- yl)acetyl]phenoxy}acetonitrile
Smiles: N#CCOc1ccccc1C(=O)CC1(O)C(=O)Nc2c1cc(F)cc2

STK575726
Synonyms: 3,6,6- trimethyl- 4- oxo- N- (2,2,6,6- tetramethylpiperidin- 4- yl)- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)NC1CC(C)(C)NC(C1)(C)C

STK575732
Synonyms: 2- [4- (4- methoxyphenyl)- 3- methyl- 1H- pyrazol- 5- yl]- 5- [(2- methylbenzyl)oxy]phenol
Smiles: COc1ccc(cc1)c1c(C)n[nH]c1c1ccc(cc1O)OCc1ccccc1C

STK848460
Synonyms: 5,6- dimethyl- 3- phenyl- N- (pyridin- 3- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1nc2n(c(c1C)NCc1cccnc1)ncc2c1ccccc1

STK575738
Synonyms: 6- chloro- 7- methyl- N- {4- [(4- methylpyrimidin- 2- yl)sulfamoyl]phenyl}- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Cc1ccnc(n1)NS(=O)(=O)c1ccc(cc1)NC(=O)c1cc(=O)c2c(o1)cc(c(c2)Cl)C

STK575745
Synonyms: (5E)- 5- {[1- (3- chloro- 4- fluorophenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 1- methyl- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CN1C(=NC(=O)/C(=C\c2cc(n(c2C)c2ccc(c(c2)Cl)F)C)/C1=O)S

STK575746
Synonyms: N'- [(E)- (2,3- dimethoxyphenyl)methylidene]- 4,7- dimethoxy- 1H- indole- 2- carbohydrazide
Smiles: COc1cccc(c1OC)/C=N/NC(=O)c1[nH]c2c(c1)c(OC)ccc2OC

STK848461
Synonyms: ethyl(2E)- 2- ({(2E)- 3- [4- (benzyloxy)- 3- methoxyphenyl]prop- 2- enoyl}imino)- 4- methyl- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: CCOC(=O)c1s/c(=N/C(=O)/C=C/c2ccc(c(c2)OC)OCc2ccccc2)/[nH]c1C

STK848462
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 1- benzyl- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: O=C(c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C)NCc1ccc2c(c1)OCO2

STK575747
Synonyms: N- (3,4- dimethylphenyl)- 5- (2- hydroxy- 4- methylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(c(c1)O)c1[nH]nc(c1)C(=O)Nc1ccc(c(c1)C)C

STK848464
Synonyms: 4- (1H- imidazol- 1- yl)- 8,10- dimethyl- 2- propylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidine
Smiles: CCCc1nc2c3c(C)cc(nc3nn2c(c1)n1cncc1)C

STK848465
Synonyms: 2,3,3a,4,7,7a- hexahydro- 1- benzothiophene1,1- dioxide
Smiles: O=S1(=O)CCC2C1CC=CC2

STK575756
Synonyms:
Smiles: CCC([C@H](C(=O)O)NC(=O)Nc1cc(Cl)ccc1Cl)C

STK575758
Synonyms: 8- (4- chlorophenyl)- 2,10- dimethyl- 11- (4- methylphenyl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)C)c1ccc(cc1)Cl

STK848468
Synonyms: 2- {[5- (4- hydroxyphenyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}- N- [(2E)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: O=C(/N=c\1/scn[nH]1)CSc1nnc(o1)c1ccc(cc1)O

STK575765
Synonyms: 4- fluoro- N- (2- methylpropyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: CC(CN(C(=O)c1ccc(cc1)F)Cc1cc2ccccc2[nH]c1=O)C

STK575766
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Clc1ccc(cc1)CSc1nn2c(n1)nc(cc2O)C

STK575769
Synonyms: 4- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 7,8- dimethyl- 2H- chromen- 2- one
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2C)C

STK848469
Synonyms: N- {4- [(2,6- dimethylpyrimidin- 4- yl)sulfamoyl]phenyl}- 6,8- dimethyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Cc1nc(C)nc(c1)NS(=O)(=O)c1ccc(cc1)NC(=O)c1cc(=O)c2c(o1)c(C)cc(c2)C

STK848470
Synonyms: 2- [2- amino- 5- (3,4- dimethoxyphenyl)pyrimidin- 4- yl]- 5- [(2- methylprop- 2- en- 1- yl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cnc(nc1c1ccc(cc1O)OCC(=C)C)N

STK575774
Synonyms: N'- [(E)- (2- hydroxyphenyl)methylidene]- 4,7- dimethoxy- 1H- indole- 2- carbohydrazide
Smiles: COc1ccc(c2c1[nH]c(c2)C(=O)N/N=C/c1ccccc1O)OC

STK575775
Synonyms: 2,4- dihydroxy- 6,7- dimethoxy- N- phenylquinoline- 3- carboxamide
Smiles: COc1cc2nc(O)c(c(c2cc1OC)O)C(=O)Nc1ccccc1

STK575776
Synonyms: 1- {2- [(2E)- 1,3- benzothiazol- 2(3H)- ylideneamino]- 2- oxoethyl}piperidine- 4- carboxamide
Smiles: O=C(/N=c\1/sc2c([nH]1)cccc2)CN1CCC(CC1)C(=O)N

STK575778
Synonyms: N- (4- {[5- tert- butyl- 3- (4- chlorophenyl)- 2- methylpyrazolo[1,5- a]pyrimidin- 7- yl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1cc(nc2n1nc(c2c1ccc(cc1)Cl)C)C(C)(C)C

STK848472
Synonyms: 3- (2- hydroxyphenyl)- 4- (3- hydroxyphenyl)- 5- (tetrahydrofuran- 2- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: Oc1cccc(c1)C1N(CC2CCCO2)C(=O)c2c1c([nH]n2)c1ccccc1O

STK575783
Synonyms: (2S)- 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- 3- phenyl- N- (2- phenylethyl)propanamide
Smiles: Oc1nc2ccccc2c(=O)n1[C@H](C(=O)NCCc1ccccc1)Cc1ccccc1

STK575786
Synonyms: 2- (2- hydroxyethyl)- 1- (3- hydroxyphenyl)- 5,7- dimethyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)O)c(=O)c1c(o2)c(C)cc(c1)C

STK848473
Synonyms: methyl4- [6,7- dimethyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 3,9- dioxo- 1,2,3,9- tetrahydrochromeno[2,3- c]pyrrol- 1- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)C)C

STK848474
Synonyms: 5- methyl- 3- (4- methylphenyl)- 7- (morpholin- 4- yl)pyrazolo[1,5- a]pyrimidine
Smiles: Cc1ccc(cc1)c1cnn2c1nc(C)cc2N1CCOCC1

STK575793
Synonyms: 4- chloro- N- (2- methoxyethyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: COCCN(C(=O)c1ccc(cc1)Cl)Cc1cc2ccccc2[nH]c1=O

STK575795
Synonyms: 5- (5- chloro- 2- hydroxyphenyl)- N- {2- [(4- fluorophenyl)carbonyl]- 1- benzofuran- 3- yl}- 1H- pyrazole- 3- carboxamide
Smiles: Fc1ccc(cc1)C(=O)c1oc2c(c1NC(=O)c1n[nH]c(c1)c1cc(Cl)ccc1O)cccc2

STK848475
Synonyms: diethyl5- {[(6,8- dimethyl- 4- oxo- 4H- chromen- 2- yl)carbonyl]amino}- 3- methylthiophene- 2,4- dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)c(C)cc(c3)C)sc(c1C)C(=O)OCC

STK575797
Synonyms: 2- diazo- 1- (pyrazin- 2- yl)ethanone
Smiles: [N-]=[N+]=CC(=O)c1cnccn1

STK575798
Synonyms: tert- butyl{3- oxo- 3- [(2E)- 2- (quinolin- 6- ylmethylidene)hydrazinyl]propyl}carbamate(non- preferredname)
Smiles: O=C(N/N=C/c1ccc2c(c1)cccn2)CCNC(=O)OC(C)(C)C

STK575801
Synonyms: 2- [(biphenyl- 4- yloxy)methyl]- 5- (pyrrolidin- 1- yl)- 1,3- oxazole- 4- carbonitrile
Smiles: N#Cc1nc(oc1N1CCCC1)COc1ccc(cc1)c1ccccc1

STK575802
Synonyms: 8- (2- chlorophenyl)- 4- hydroxy- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Clc1ccccc1n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK575804
Synonyms: N- [5- hydroxy- 2- (trifluoromethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1cc(O)nc2n1nc(n2)C(F)(F)F

STK575805
Synonyms: N- {[2- (4- fluorophenyl)ethyl]carbamoyl}- L- valine
Smiles: CC([C@@H](C(=O)O)NC(=O)NCCc1ccc(cc1)F)C

STK575809
Synonyms: 4- [4- (benzyloxy)- 3- methoxyphenyl]- 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 5- (2- hydroxyethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1ccc(c(c1)OC)OCc1ccccc1)c([nH]n2)c1cc(Cl)c(cc1O)C

STK848477
Synonyms: 7- chloro- 1'- methyl- 2- (2- phenylethyl)- 2H- spiro[chromeno[2,3- c]pyrrole- 1,3'- indole]- 2',3,9(1'H)- trione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C21c1ccccc1N(C2=O)C)CCc1ccccc1

STK575813
Synonyms: 3- cyclopentyl- 6- ethyl- 10- methyl- 3,4- dihydro- 2H,8H- chromeno[6,7- e][1,3]oxazin- 8- one
Smiles: CCc1cc(=O)oc2c1cc1CN(COc1c2C)C1CCCC1

STK848480
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5- (thiophen- 2- ylmethyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1ccc2c(c1)OCCO2)Cc1cccs1

STK575817
Synonyms: 5- (2- hydroxy- 3,5- dimethylphenyl)- N- {4- [(2- methylpiperidin- 1- yl)sulfonyl]phenyl}- 1H- pyrazole- 3- carboxamide
Smiles: Cc1cc(C)c(c(c1)c1[nH]nc(c1)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCCC1C)O

STK575819
Synonyms: 11- (2- chlorophenyl)- 10- methyl- 8- phenyl- 2- (pyridin- 2- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccccn1)c1ccccc1

STK575820
Synonyms: [(5S)- 5- (2,3- dihydro- 1,4- benzodioxin- 6- ylcarbamoyl)- 3- (4- methoxyphenyl)- 4,5- dihydro- 1,2- oxazol- 5- yl]aceticacid
Smiles: COc1ccc(cc1)C1=NO[C@@](C1)(CC(=O)O)C(=O)Nc1ccc2c(c1)OCCO2

STK575822
Synonyms: 6- hydroxy- 3- methyl- 8- (4- methylpiperazin- 1- yl)- 7- {2- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]ethyl}- 3,7- dihydro- 2H- purin- 2- one
Smiles: CN1CCN(CC1)c1nc2c(n1CCSc1nnnn1c1ccccc1)c(O)nc(=O)n2C

STK575824
Synonyms: (4E)- 4- {[(1,1- dioxidotetrahydrothiophen- 3- yl)amino]methylidene}- 2- [3- (trifluoromethyl)phenyl]isoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1N(c2cccc(c2)C(F)(F)F)C(=O)c2c(/C/1=C\NC1CCS(=O)(=O)C1)cccc2

STK848483
Synonyms: N- (2- methoxyethyl)- 5- methyl- 3- phenyl- 2- (trifluoromethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: COCCNc1cc(C)nc2n1nc(c2c1ccccc1)C(F)(F)F

STK575828
Synonyms: 2- {[(5E)- 5- (acetylimino)- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N- (1,2- dihydroacenaphthylen- 5- yl)acetamide
Smiles: O=C(Nc1ccc2c3c1cccc3CC2)CSc1n[nH]/c(=N\C(=O)C)/s1

STK848484
Synonyms: 3- (2,4- dimethoxyphenyl)- 8- (2- fluorophenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccccc1F)c1ccc(cc1OC)OC

STK575830
Synonyms: methyl4- [1- (4- bromophenyl)- 1- oxobutan- 2- yl]- 5,5- dimethyl- 2- oxotetrahydrofuran- 3- carboxylate
Smiles: CCC(C1C(C(=O)OC)C(=O)OC1(C)C)C(=O)c1ccc(cc1)Br

STK575833
Synonyms: 9- [1- phenyl- 3- (pyridin- 3- yl)- 1H- pyrazol- 4- yl]- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: OC1=C2C(=Nc3n(C2c2cn(nc2c2cccnc2)c2ccccc2)ncn3)CCC1

STK575836
Synonyms: 3- (2- bromophenoxy)- 7- hydroxy- 8- [(3- methylpiperidin- 1- yl)methyl]- 4H- chromen- 4- one
Smiles: CC1CCCN(C1)Cc1c(O)ccc2c1occ(c2=O)Oc1ccccc1Br

STK575837
Synonyms: 2- (2- methoxyphenyl)- 12- phenyl- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccccc1c1nn2c(n1)c1c(nc2)OC2=C(C1c1ccccc1)C(=O)CCC2

STK575841
Synonyms: 2- ethyl- 3- (furan- 2- ylmethyl)- 8- methoxy- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: CCc1nc2oc3cc(OC)ccc3c(=O)c2c(=O)n1Cc1ccco1

STK575843
Synonyms: 3- (furan- 2- ylmethyl)- 8- methoxy- 2- (propan- 2- yl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)c(=O)n(c(n1)C(C)C)Cc1ccco1

STK575844
Synonyms: 1- (3- bromophenyl)- 4- (4- methylphenyl)- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: Cc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)Br

STK575847
Synonyms: 4- (ethylsulfanyl)- 7,7- dimethyl- 2- (3- methylphenyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: CCSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C

STK848487
Synonyms: 2- methyl- N- [3- (morpholin- 4- yl)propyl]- 3- phenyl- 5- propylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CCCc1cc(NCCCN2CCOCC2)n2c(n1)c(c1ccccc1)c(n2)C

STK575852
Synonyms: N- [3- (1H- indol- 3- yl)propanoyl]alanine
Smiles: O=C(NC(C(=O)O)C)CCc1c[nH]c2c1cccc2

STK575853
Synonyms: 1- (4- fluorophenyl)- 2- hydroxy- 6- (1- phenylethyl)- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: Fc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)C(c1ccccc1)C

STK848490
Synonyms: (3- amino- 6- methylthieno[2,3- b]pyridin- 2- yl)(1,3- benzodioxol- 5- yl)methanone
Smiles: Cc1ccc2c(n1)sc(c2N)C(=O)c1ccc2c(c1)OCO2

STK575856
Synonyms: 2- (furan- 2- ylmethyl)- 2,3- dihydro- 1H- isoindol- 1- imine
Smiles: N=C1N(Cc2ccco2)Cc2c1cccc2

STK575859
Synonyms: 4- chloro- N- methyl- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)C

STK575860
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (3- hydroxyphenyl)- 5- (2- methoxyethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COCCN1C(=O)c2c(C1c1cccc(c1)O)c([nH]n2)c1cc(Cl)c(cc1O)C

STK575862
Synonyms: 4- hydroxy- 2- (methylsulfanyl)- 5- (3,4,5- trimethoxyphenyl)- 5,8- dihydropyrido[2,3- d]pyrimidin- 7(6H)- one
Smiles: CSc1nc(O)c2c(n1)NC(=O)CC2c1cc(OC)c(c(c1)OC)OC

STK575864
Synonyms: 5- [(2,5- dimethylbenzyl)oxy]- 2- [4- (2- methoxyphenoxy)- 1H- pyrazol- 3- yl]phenol
Smiles: COc1ccccc1Oc1c[nH]nc1c1ccc(cc1O)OCc1cc(C)ccc1C

STK848491
Synonyms: 2- [(2,3- dimethylphenyl)amino]- 8- methyl- 4- (4- methylphenyl)- 4H- pyrimido[1,2- a][1,3,5]triazin- 6- ol
Smiles: Cc1ccc(cc1)C1N=C(Nc2cccc(c2C)C)N=c2n1c(O)cc(n2)C

STK848492
Synonyms: {4- [2,5- dimethyl- 3- (4- methylphenyl)pyrazolo[1,5- a]pyrimidin- 7- yl]piperazin- 1- yl}acetonitrile
Smiles: N#CCN1CCN(CC1)c1cc(C)nc2n1nc(c2c1ccc(cc1)C)C

STK575867
Synonyms: methylN- [(3- methoxyphenyl)carbamoyl]- D- leucinate
Smiles: COC(=O)[C@H](NC(=O)Nc1cccc(c1)OC)CC(C)C

STK575871
Synonyms: 2- [(6- chloro- 4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 3- ylmethyl)acetamide
Smiles: O=C(NCc1cccnc1)COc1cc2oc(=O)cc(c2cc1Cl)C

STK575874
Synonyms: 2- ammonio- 3- [(6- bromo- 2- methylquinolin- 4- yl)sulfanyl]propanoate
Smiles: [O-]C(=O)C([NH3+])CSc1cc(C)nc2c1cc(Br)cc2

STK575875
Synonyms: 7- (2- ethoxyethyl)- 8- (ethylsulfanyl)- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCOCCn1c(SCC)nc2c1c(O)nc(=O)n2C

STK848494
Synonyms: ethyl[(2Z)- 1,3- benzothiazol- 2(3H)- ylideneamino](oxo)acetate
Smiles: CCOC(=O)C(=O)/N=c/1\sc2c([nH]1)cccc2

STK848495
Synonyms: (5Z)- 5- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=NC1=O)S

STK848496
Synonyms: 3- (2,5- dimethoxyphenyl)- 2- oxo- 2H- chromen- 7- ylmorpholine- 4- carboxylate
Smiles: COc1ccc(cc1c1cc2ccc(cc2oc1=O)OC(=O)N1CCOCC1)OC

STK575877
Synonyms: N,N- dimethyl- N'- [5- methyl- 3- phenyl- 2- (trifluoromethyl)pyrazolo[1,5- a]pyrimidin- 7- yl]ethane- 1,2- diamine
Smiles: CN(CCNc1cc(C)nc2n1nc(c2c1ccccc1)C(F)(F)F)C

STK575881
Synonyms: 8- (2,4- dimethoxyphenyl)- 3- (3- hydroxypropyl)- 1,7- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccc(cc1OC)OC)C

STK575883
Synonyms: 3- [(5,6- dimethylfuro[2,3- d]pyrimidin- 4- yl)amino]propan- 1- ol
Smiles: Cc1c(C)oc2c1c(NCCCO)ncn2

STK575888
Synonyms: 4- [(2E)- 2- {[5- (4- nitrophenyl)furan- 2- yl]methylidene}hydrazinyl]- 5- phenylthieno[2,3- d]pyrimidine
Smiles: [O-][N+](=O)c1ccc(cc1)c1ccc(o1)/C=N/Nc1ncnc2c1c(cs2)c1ccccc1

STK848498
Synonyms: 6- methyl- 3- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl]- 1,2,4- triazin- 5- ol
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/Nc1nnc(c(n1)O)C

STK848499
Synonyms: N- cyclopentyl- 2- methyl- 3- phenyl- 6,7- dihydro- 5H- cyclopenta[d]pyrazolo[1,5- a]pyrimidin- 8- amine
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2NC2CCCC2)CCC1

STK575891
Synonyms: ethyl8- methyl- 10- phenyl- 2- (pyridin- 3- yl)- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 9- carboxylate
Smiles: CCOC(=O)C1=C(C)Oc2c(C1c1ccccc1)c1nc(nn1cn2)c1cccnc1

STK848500
Synonyms: 5- (2- hydroxyethyl)- 3- (2- hydroxyphenyl)- 4- (3- hydroxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)O)c([nH]n2)c1ccccc1O

STK848502
Synonyms: 3- (2- hydroxyphenyl)- 5- (2- methoxyethyl)- 4- (3- methoxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COCCN1C(=O)c2c(C1c1cccc(c1)OC)c([nH]n2)c1ccccc1O

STK575895
Synonyms: (5Z)- 5- ({1- [2- (2- chlorophenoxy)ethyl]- 1H- indol- 3- yl}methylidene)- 3- ethyl- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCN1C(=O)N=C(/C(=C/c2cn(c3c2cccc3)CCOc2ccccc2Cl)/C1=O)O

STK575896
Synonyms: 2- (1,3- benzothiazol- 2- ylamino)- 4- phenyl- 4,6,7,8- tetrahydroquinazolin- 5- ol
Smiles: OC1=C2C(=NC(=NC2c2ccccc2)Nc2nc3c(s2)cccc3)CCC1

STK575897
Synonyms: N- (furan- 2- ylmethyl)- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]methanesulfonamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)C)Cc1ccco1

STK575902
Synonyms: 1- amino- 4- [(2- hydroxyethyl)amino]- 2- [(2- methylpropyl)amino]anthracene- 9,10- dione
Smiles: OCCNc1cc(NCC(C)C)c(c2c1C(=O)c1ccccc1C2=O)N

STK848505
Synonyms: 2- methyl- 4- oxo- 3- phenyl- 4H- chromen- 7- ylmorpholine- 4- carboxylate
Smiles: O=C(N1CCOCC1)Oc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK575908
Synonyms: (5E)- 1- butyl- 2- hydroxy- 5- {1- [2- (naphthalen- 1- yl)hydrazinyl]ethylidene}pyrimidine- 4,6(1H,5H)- dione
Smiles: CCCCN1C(=NC(=O)/C(=C(\NNc2cccc3c2cccc3)/C)/C1=O)O

STK575910
Synonyms: 2- (furan- 2- yl)- 10- methyl- 8- phenyl- 11- (pyridin- 3- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nn(c2c1C(c1cccnc1)c1c(O2)ncn2c1nc(n2)c1ccco1)c1ccccc1

STK848506
Synonyms: ethyl2- {[(Z)- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)methyl]amino}- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(N/C=C\2/C(=NC(=NC2=O)O)O)sc2c1CCCCC2

STK575919
Synonyms: 3- (2- fluorophenyl)- 2',6'- dihydroxy- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidin]- 4'- one
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1ccccc1N1C2CN(CC1)c1ccccc1F

STK575920
Synonyms: (4E)- 5- (4- chlorophenyl)- 4- [(4- chlorophenyl)(hydroxy)methylidene]pyrrolidine- 2,3- dione
Smiles: Clc1ccc(cc1)/C(=C\1/C(NC(=O)C1=O)c1ccc(cc1)Cl)/O

STK575922
Synonyms: 2- [(2E)- (2H- chromen- 3- ylmethylidene)hydrazinylidene]- 2,3- dihydro- 1H- benzimidazole
Smiles: c1ccc2c(c1)C=C(CO2)/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK575927
Synonyms: (2E)- 3- (5,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)prop- 2- enoicacid
Smiles: OC(=O)/C=C/c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2

STK575928
Synonyms: 3- amino- 1- (4,6- dimethylpyrimidin- 2- yl)- 1H- pyrazol- 5- ol
Smiles: Nc1nn(c(c1)O)c1nc(C)cc(n1)C

STK575930
Synonyms: 6- amino- 4- (4- hydroxy- 3- methoxyphenyl)- 3- methyl- 1- phenyl- 1H- pyrazolo[3,4- b]pyridine- 5- carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(c(c1)OC)O)c(C)nn2c1ccccc1

STK575931
Synonyms: 5- (benzyloxy)- 2- [4- phenyl- 3- (trifluoromethyl)- 1H- pyrazol- 5- yl]phenol
Smiles: Oc1cc(OCc2ccccc2)ccc1c1[nH]nc(c1c1ccccc1)C(F)(F)F

STK848512
Synonyms: methyl5- acetyl- 4- methyl- 2- {[(4- oxo- 4H- chromen- 2- yl)carbonyl]amino}thiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)cccc3)sc(c1C)C(=O)C

STK848513
Synonyms: 2- amino- 4- hydroxy- 5- [4- (methylsulfanyl)phenyl]- 5,8- dihydropyrido[2,3- d]pyrimidin- 7(6H)- one
Smiles: CSc1ccc(cc1)C1CC(=O)Nc2c1c(O)nc(n2)N

STK575932
Synonyms: 2- ({4- amino- 5- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- chloro- 2- methylphenyl)acetamide
Smiles: Clc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1C)Cl

STK575939
Synonyms: N- (3- chloro- 2- methylphenyl)- 5- (2- hydroxy- 4,5- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1cc(C)c(cc1O)C)Nc1cccc(c1C)Cl

STK575944
Synonyms: 1- (4- methoxyphenyl)- 5- oxo- N- {(2S)- 1- oxo- 1- [(1- phenylethyl)amino]propan- 2- yl}pyrrolidine- 3- carboxamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)NC(c1ccccc1)C)C

STK575950
Synonyms: N'- [7- (furan- 2- ylmethyl)- 5,6- dimethyl- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl]- N,N- dimethylethane- 1,2- diamine
Smiles: CN(CCNc1ncnc2c1c(C)c(n2Cc1ccco1)C)C

STK575952
Synonyms: (5Z)- 5- (3,4- dimethoxybenzylidene)- 2- methyl- 3- (1,3- thiazol- 2- yl)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: COc1cc(ccc1OC)/C=C/1\N=C(N(C1=O)c1nccs1)C

STK575956
Synonyms: 4- hydroxy- 5- (4- hydroxy- 3- methoxyphenyl)- 2- (methylsulfanyl)- 5,8- dihydropyrido[2,3- d]pyrimidin- 7(6H)- one
Smiles: CSc1nc(O)c2c(n1)NC(=O)CC2c1ccc(c(c1)OC)O

STK575957
Synonyms: 2- (4- fluorobenzyl)- 1- (3- hydroxyphenyl)- 5,7- dimethyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Oc1cccc(c1)C1N(Cc2ccc(cc2)F)C(=O)c2c1c(=O)c1c(o2)c(C)cc(c1)C

STK575962
Synonyms: 5- (4- chlorophenyl)- 3- (furan- 2- ylmethyl)- 4- imino- 3,5- dihydro- 4H- chromeno[2,3- d]pyrimidin- 8- ol
Smiles: Clc1ccc(cc1)C1c2ccc(cc2Oc2c1c(=N)n(cn2)Cc1ccco1)O

STK575963
Synonyms: ethyl4- [(8S,8aR,11aS)- 8- (furan- 2- ylcarbonyl)- 9,11- dioxo- 8a,9,11a,11b- tetrahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinolin- 10(11H)- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1C2c2ccccc2C=C1)C(=O)c1ccco1

STK575966
Synonyms: 2- (2- amino- 6- methyl- 5- phenylpyrimidin- 4- yl)- 5- [(4- chlorobenzyl)oxy]phenol
Smiles: Clc1ccc(cc1)COc1ccc(c(c1)O)c1nc(N)nc(c1c1ccccc1)C

STK848520
Synonyms: ethyl2- methyl- 4- [(E)- 2- phenylethenyl]- 4,10- dihydropyrimido[1,2- a]benzimidazole- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1/C=C/c1ccccc1)c1ccccc1[nH]2

STK575967
Synonyms: N- [(thiophen- 2- ylmethyl)carbamoyl]- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)NCc1cccs1

STK575975
Synonyms: (3S)- N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: O=C([C@H]1NCc2c(C1)cccc2)/N=c\1/sc2c([nH]1)cccc2

STK575977
Synonyms: 5- (2- hydroxy- 4,5- dimethylphenyl)- N- [4- (piperidin- 1- ylsulfonyl)phenyl]- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1cc(C)c(cc1O)C)Nc1ccc(cc1)S(=O)(=O)N1CCCCC1

STK575980
Synonyms: 4- (4- bromophenyl)- 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- (3- hydroxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1ccc(cc1)Br)c([nH]n2)c1cc(C)cc(c1O)C

STK575988
Synonyms: 7- hydroxy- 5- (4- hydroxy- 3- methoxyphenyl)- 2- methyl- 5,6- dihydropyrido[2,3- d]pyrimidin- 4(3H)- one
Smiles: COc1cc(ccc1O)C1CC(=Nc2c1c(=O)[nH]c(n2)C)O

STK848525
Synonyms: 2- [2- amino- 5- (4- methoxyphenoxy)pyrimidin- 4- yl]- 5- [(4- ethenylbenzyl)oxy]phenol
Smiles: COc1ccc(cc1)Oc1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1)C=C)N

STK848526
Synonyms: 2- (2- {[3- (2- methoxyphenyl)- 2,5- dimethylpyrazolo[1,5- a]pyrimidin- 7- yl]amino}ethoxy)ethanol
Smiles: OCCOCCNc1cc(C)nc2n1nc(c2c1ccccc1OC)C

STK575992
Synonyms: 6- (3- chlorobenzyl)- 5- methyl- 2- (trifluoromethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Clc1cccc(c1)Cc1c(C)nc2n(c1O)nc(n2)C(F)(F)F

STK848527
Synonyms: 3- cyclohexyl- 8- [4- (methylsulfanyl)phenyl]- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)SC)C1CCCCC1

STK575997
Synonyms: 1- (5- methyl- 1- {6- [(1- phenylethyl)amino]pyrimidin- 4- yl}- 1H- pyrazol- 4- yl)ethanone
Smiles: CC(c1ccccc1)Nc1ncnc(c1)n1ncc(c1C)C(=O)C

STK575998
Synonyms: 1- ({1- [(4- methylphenyl)sulfonyl]piperidin- 4- yl}carbonyl)- N- (2,2,6,6- tetramethylpiperidin- 4- yl)- L- prolinamide
Smiles: O=C([C@@H]1CCCN1C(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)NC1CC(C)(C)NC(C1)(C)C

STK576005
Synonyms: 2- (2- methoxy- 5- methylphenyl)- 2,3- dihydro- 1H- isoindol- 1- imine
Smiles: COc1ccc(cc1N1Cc2c(C1=N)cccc2)C

STK576007
Synonyms: N- tert- butyl- 2- (pyridin- 2- yl)quinazolin- 4- amine
Smiles: CC(Nc1nc(nc2c1cccc2)c1ccccn1)(C)C

STK848529
Synonyms: 2- methoxyethyl5- hydroxy- 1,2- dimethyl- 1H- indole- 3- carboxylate
Smiles: Cc1c(C(=O)OCCOC)c2c(n1C)ccc(c2)O

STK576011
Synonyms: N- [3- (3,4- dimethoxyphenyl)- 4- oxo- 4H- chromen- 2- yl]thiophene- 2- carboxamide
Smiles: COc1cc(ccc1OC)c1c(NC(=O)c2cccs2)oc2c(c1=O)cccc2

STK848531
Synonyms: 7- [(4- chlorobenzyl)sulfanyl]- 2- hydroxy- 3- phenylpyrimido[4,5- d]pyrimidin- 4(3H)- one
Smiles: Clc1ccc(cc1)CSc1ncc2c(n1)nc(n(c2=O)c1ccccc1)O

STK576017
Synonyms: 1- [4- hydroxy- 6- (methoxymethyl)pyrimidin- 2- yl]- 3- (2- methylphenyl)guanidine
Smiles: COCc1nc(NC(=N)Nc2ccccc2C)nc(c1)O

STK576018
Synonyms: ethyl4- [(5- bromo- 3- methyl- 1H- indol- 2- yl)carbonyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)c1[nH]c2c(c1C)cc(cc2)Br

STK576021
Synonyms: N- (4- fluorophenyl)- 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1ccc(cc1)F

STK576022
Synonyms: (5Z)- 3- cyclohexyl- 5- {1- [(2,4- dimethoxyphenyl)amino]ethylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: COc1cc(OC)ccc1N/C(=C\1/C(=NC(=O)N(C1=O)C1CCCCC1)O)/C

STK576023
Synonyms: 5- (2- hydroxy- 3,5- dimethylphenyl)- N- (pyridin- 3- yl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1cc(C)c(c(c1)c1[nH]nc(c1)C(=O)Nc1cccnc1)O

STK576028
Synonyms: 2,8- dimethyl- N- (propan- 2- yl)- 4,5- dihydrofuro[3,2- e][1,3]benzothiazole- 7- carboxamide
Smiles: CC(NC(=O)c1oc2c(c1C)c1nc(sc1CC2)C)C

STK848533
Synonyms: (2Z)- 2- (2- chloro- 6- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylpropanoate
Smiles: CCC(=O)Oc1ccc2c(c1)O/C(=C\c1c(F)cccc1Cl)/C2=O

STK576030
Synonyms: 4- (4- methoxyphenyl)- 4,10- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: COc1ccc(cc1)C1N=C(N)N=c2n1c1ccccc1[nH]2

STK848534
Synonyms: 6,7- dimethyl- 4- oxo- N- [4- (pyrimidin- 2- ylsulfamoyl)phenyl]- 4H- chromene- 2- carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cc(c(c2)C)C)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1

STK848536
Synonyms: 1- benzyl- N,N- dimethyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: CN(C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1)C

STK576045
Synonyms: 2- [(3,5- dimethylpiperidin- 1- yl)carbonyl]- 1- (3- methoxypropyl)pyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 4(1H)- one
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)N1CC(C)CC(C1)C

STK576053
Synonyms: (5Z)- 1- (2- methoxyphenyl)- 5- [5- (thiophen- 2- yl)pyrazolidin- 3- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccccc1N1C(=O)NC(=O)/C(=C\2/NNC(C2)c2cccs2)/C1=O

STK576060
Synonyms: 5- (3- methoxyphenyl)- 4- {[(E)- (5- methylfuran- 2- yl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(o1)C

STK576064
Synonyms: 2- [(6- chloro- 3,4- dimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 3- ylmethyl)acetamide
Smiles: O=C(NCc1cccnc1)COc1cc2oc(=O)c(c(c2cc1Cl)C)C

STK576065
Synonyms: 8- {[2- (diethylamino)ethyl]amino}- 6- hydroxy- 3- methyl- 7- (4- methylbenzyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCN(CCNc1nc2c(n1Cc1ccc(cc1)C)c(O)nc(=O)n2C)CC

STK576067
Synonyms: 2- [(5Z)- 5- benzylidene- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- [2- (3,4- dihydroxyphenyl)- 2- oxoethyl]- N- methylacetamide
Smiles: CN(C(=O)CN1C(=O)S/C(=C\c2ccccc2)/C1=O)CC(=O)c1ccc(c(c1)O)O

STK576068
Synonyms: (3aS,4R,4aS,7aR,8R,8aS)- 6- (4- acetylphenyl)- 3- (4- methoxyphenyl)- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- epoxy[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: COc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1O[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)C(=O)C

STK576070
Synonyms: N- [(5- chloro- 1- methyl- 1H- indol- 2- yl)carbonyl]- L- phenylalanine
Smiles: OC(=O)[C@@H](NC(=O)c1cc2c(n1C)ccc(c2)Cl)Cc1ccccc1

STK576072
Synonyms: 5- ({3- [(5E)- 5- benzylidene- 2,4- dioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)C(=O)O)O)CCN1C(=O)S/C(=C/c2ccccc2)/C1=O

STK576074
Synonyms: 2- {[2,2- dimethyl- 5- (2- methylpropyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- yl]amino}butan- 1- ol
Smiles: CCC(Nc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C)CO

STK576078
Synonyms: 5- cycloheptylidene- 4- hydroxy- 1,3- thiazole- 2(5H)- thione
Smiles: S=C1N=C(C(=C2CCCCCC2)S1)O

STK848539
Synonyms: (2Z)- 3- oxo- 2- (pyridin- 4- ylmethylidene)- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzenesulfonate
Smiles: Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccncc1)/C2=O

STK576079
Synonyms: 9- [4- (4- chlorobenzyl)piperazin- 1- yl]- 2- methyl- 3- phenyl- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazoline
Smiles: Clc1ccc(cc1)CN1CCN(CC1)c1c2CCCCc2nc2n1nc(c2c1ccccc1)C

STK848541
Synonyms: 1- benzyl- N- (4- methoxyphenyl)- 7- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cc(cc1)C

STK848542
Synonyms: (2Z)- 2- (furan- 2- ylmethylidene)- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl1,3- benzodioxole- 5- carboxylate
Smiles: Cc1c(ccc2c1O/C(=C\c1ccco1)/C2=O)OC(=O)c1ccc2c(c1)OCO2

STK576083
Synonyms: 2- [2- amino- 5- (2- methoxyphenoxy)pyrimidin- 4- yl]- 5- [(2,4- dichlorobenzyl)oxy]phenol
Smiles: COc1ccccc1Oc1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1Cl)Cl)N

STK576086
Synonyms: 10- (furan- 2- yl)- 1,3- dimethyl- 5- (3- nitrophenyl)- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: [O-][N+](=O)c1cccc(c1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1ccco1

STK576087
Synonyms: 3- (4- chlorophenyl)- 7- (1H- imidazol- 1- yl)- 2- methyl- 5- phenylpyrazolo[1,5- a]pyrimidine
Smiles: Clc1ccc(cc1)c1c(C)nn2c1nc(cc2n1cncc1)c1ccccc1

STK848546
Synonyms: N- (2- hydroxyethyl)- 1- (3- methoxypropyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: OCCNC(=O)c1cc2c(n1CCCOC)nc1n(c2=O)cccc1

STK576096
Synonyms: {(5S)- 5- [(4- fluorophenyl)carbamoyl]- 3- [(E)- 2- phenylethenyl]- 4,5- dihydro- 1,2- oxazol- 5- yl}aceticacid
Smiles: OC(=O)C[C@]1(ON=C(C1)/C=C/c1ccccc1)C(=O)Nc1ccc(cc1)F

STK848547
Synonyms: 2- {4- [4- (4- bromophenyl)- 3- methyl- 1H- pyrazol- 5- yl]- 3- hydroxyphenoxy}acetohydrazide
Smiles: NNC(=O)COc1ccc(c(c1)O)c1[nH]nc(c1c1ccc(cc1)Br)C

STK848548
Synonyms: 7- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 5- methyl- 2- (trifluoromethyl)[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Cc1nc2nc(nn2c(c1)n1nc(cc1C)C)C(F)(F)F

STK576105
Synonyms: N- {6- hydroxy- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 3- methyl- 2- oxo- 3,7- dihydro- 2H- purin- 8- yl}phenylalanine
Smiles: OC(Cn1c(NC(C(=O)O)Cc2ccccc2)nc2c1c(O)nc(=O)n2C)COc1ccc(cc1)C

STK848551
Synonyms: ethyl6- bromo- 5- (cyanomethoxy)- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: N#CCOc1cc2c(cc1Br)oc(c2C(=O)OCC)c1ccc(cc1)OC

STK848552
Synonyms: (4Z)- 5- methyl- 4- {[(2- methylquinolin- 8- yl)amino]methylidene}- 2- phenyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: Cc1ccc2c(n1)c(ccc2)N/C=C\1/C(=NN(C1=O)c1ccccc1)C

STK848553
Synonyms: N- [3- (morpholin- 4- yl)propyl]- 3- phenyl- 5- propylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CCCc1cc(NCCCN2CCOCC2)n2c(n1)c(cn2)c1ccccc1

STK576111
Synonyms: 3- (2- hydroxy- 3,5- dimethylphenyl)- 4- (3- methoxyphenyl)- 5- [2- (4- methoxyphenyl)ethyl]- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1cccc(c1)OC)c([nH]n2)c1cc(C)cc(c1O)C

STK576113
Synonyms: 2- (5- hydroxy- 2- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl)hexahydro- 1H- isoindole- 1,3(2H)- dione
Smiles: Oc1nc2nc(nn2c(c1)N1C(=O)C2C(C1=O)CCCC2)c1ccccc1

STK576116
Synonyms: 3- amino- N'- [(E)- quinolin- 6- ylmethylidene]propanehydrazide(non- preferredname)
Smiles: NCCC(=O)N/N=C/c1ccc2c(c1)cccn2

STK576117
Synonyms: 1- (4- fluorophenyl)- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK576120
Synonyms: 2- (ethylsulfanyl)- 6,6- dimethyl- 9- (pyridin- 3- yl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CC(C1)(C)C)C2c1cccnc1

STK576124
Synonyms: 5- (2- hydroxyphenyl)- N- [2- (phenylcarbamoyl)- 1- benzofuran- 3- yl]- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccccc1O)Nc1c(oc2c1cccc2)C(=O)Nc1ccccc1

STK576125
Synonyms: 2- [4- (4- methoxyphenyl)- 3- methyl- 1H- pyrazol- 5- yl]- 5- [(3- methylbut- 2- en- 1- yl)oxy]phenol
Smiles: COc1ccc(cc1)c1c(C)n[nH]c1c1ccc(cc1O)OCC=C(C)C

STK848555
Synonyms: 1- (3- methoxypropyl)- 9- methyl- 4- oxo- N- phenyl- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)Nc1ccccc1

STK848556
Synonyms: 2- (3- hydroxy- 5- methyl- 4H- pyrazol- 4- yl)- N'- [(E)- (4- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)CC1C(=NN=C1O)C

STK576127
Synonyms: ethyl1- [(5- bromo- 3- methyl- 1H- indol- 2- yl)carbonyl]piperidine- 3- carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C(=O)c1[nH]c2c(c1C)cc(cc2)Br

STK576128
Synonyms: 8- (4- ethoxy- 3- methoxyphenyl)- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCOc1ccc(cc1OC)c1[nH]c2c(n1)n(C)c(=O)nc2O

STK848557
Synonyms: N,1- dibenzyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: O=C(c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1)NCc1ccccc1

STK576134
Synonyms: N- [(5- chloro- 1- methyl- 1H- indol- 2- yl)carbonyl]- L- leucyl- beta- alanine
Smiles: CC(C[C@@H](C(=O)NCCC(=O)O)NC(=O)c1cc2c(n1C)ccc(c2)Cl)C

STK576144
Synonyms: 5- {[(2Z)- 3- (2,4- difluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]amino}- 5- oxopentanoicacid
Smiles: OC(=O)CCCC(=O)/N=C/1\SC2C(N1c1ccc(cc1F)F)CS(=O)(=O)C2

STK576146
Synonyms: 5- (2- hydroxy- 5- methylphenyl)- N- (4- sulfamoylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(c(c1)c1[nH]nc(c1)C(=O)Nc1ccc(cc1)S(=O)(=O)N)O

STK576147
Synonyms: N- [(3Z)- 1- ethyl- 8- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 4- methylbenzenesulfonamide
Smiles: CCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)C)/c2c1nc1c(c2)cccc1C

STK576148
Synonyms: N- (2- chloro- 6- fluorobenzyl)- 3- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)propanamide
Smiles: O=C(CCc1c(=O)oc2c(c1C)ccc(c2)O)NCc1c(F)cccc1Cl

STK576150
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 5- butyl- 6- methylpyrimidin- 4- ol
Smiles: CCCCc1c(C)nc(nc1O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK576152
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- ethoxy- N- (thiophen- 2- ylmethyl)benzamide
Smiles: CCOc1ccccc1C(=O)N(C1CCS(=O)(=O)C1)Cc1cccs1

STK576154
Synonyms: 1- [3- (1,3- benzodioxol- 5- yl)- 6- methylheptyl]piperidine
Smiles: CC(CCC(c1ccc2c(c1)OCO2)CCN1CCCCC1)C

STK576158
Synonyms: 1- benzyl- 6- cyclohexyl- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(S)n(c2c1CN(CN2)C1CCCCC1)Cc1ccccc1

STK576162
Synonyms: 12- (furan- 2- yl)- 2- (phenoxymethyl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: O=C1CCCC2=C1C(c1ccco1)c1c(O2)ncn2c1nc(n2)COc1ccccc1

STK576163
Synonyms: 5- [(2E)- 3- (6- fluoro- 4- oxo- 4H- chromen- 3- yl)prop- 2- en- 1- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)C(=C/C=C/c2coc3c(c2=O)cc(cc3)F)C(=O)N1

STK576173
Synonyms: 3- chloro- 1- (3- chloro- 4- methylphenyl)- 4- (cyclohexylamino)- 1H- pyrrole- 2,5- dione
Smiles: O=C1N(c2ccc(c(c2)Cl)C)C(=O)C(=C1NC1CCCCC1)Cl

STK576178
Synonyms: N- cyclohexyl- 5- fluoro- N- methyl- 1H- indole- 2- carboxamide
Smiles: Fc1ccc2c(c1)cc([nH]2)C(=O)N(C1CCCCC1)C

STK576179
Synonyms: 2,3- dihydro- 1H- cyclopenta[b]quinolin- 9- yl[4- (4- methoxyphenyl)piperazin- 1- yl]methanone
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)c1c2CCCc2nc2c1cccc2

STK576187
Synonyms: 2- ({4- [(5E)- 5- (furan- 2- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}amino)- 5- hydroxybenzoicacid
Smiles: O=C(Nc1ccc(cc1C(=O)O)O)CCCN1C(=S)S/C(=C/c2ccco2)/C1=O

STK848568
Synonyms: 2- [(7,7- dimethyl- 2- phenyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl)sulfanyl]ethanol
Smiles: OCCSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK576194
Synonyms: 5- (4- chlorophenyl)- 3- (3,5- dichloro- 2- hydroxyphenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1cc(Cl)cc(c1O)Cl

STK576195
Synonyms: (3S)- N- {(2S)- 1- [(furan- 2- ylmethyl)amino]- 4- methyl- 1- oxopentan- 2- yl}- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: CC(C[C@@H](C(=O)NCc1ccco1)NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK576197
Synonyms: N- (5- hydroxy- 2- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl)- 3- nitrobenzamide
Smiles: Oc1cc(NC(=O)c2cccc(c2)[N+](=O)[O-])n2c(n1)nc(n2)c1ccccc1

STK576198
Synonyms: ethyl10- (3,4- dimethoxyphenyl)- 2- (2- hydroxyphenyl)- 8- methyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 9- carboxylate
Smiles: CCOC(=O)C1=C(C)Oc2c(C1c1ccc(c(c1)OC)OC)c1nc(nn1cn2)c1ccccc1O

STK576199
Synonyms: 3- (2- hydroxyphenyl)- 1- (1H- indol- 3- ylmethyl)- 4,6- dioxo- 5- phenyloctahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: Oc1ccccc1C1NC(C2C1C(=O)N(C2=O)c1ccccc1)(Cc1c[nH]c2c1cccc2)C(=O)O

STK576202
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)NCc1ccccc1F)C

STK576203
Synonyms: 5- tert- butyl- 3- (4- chlorophenyl)- N- (3,4- dimethylphenyl)- 2- methylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Clc1ccc(cc1)c1c(C)nn2c1nc(cc2Nc1ccc(c(c1)C)C)C(C)(C)C

STK576204
Synonyms: (5Z)- 3- (1,3- benzodioxol- 5- ylmethyl)- 5- [(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CC1Oc2c(C1)cc(cc2)/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2

STK848569
Synonyms: 4- [(6- ethyl- 2- methylthieno[2,3- d]pyrimidin- 4- yl)amino]phenol
Smiles: CCc1sc2c(c1)c(Nc1ccc(cc1)O)nc(n2)C

STK576206
Synonyms: N- (3,4- difluorophenyl)- 2- (4- oxoquinazolin- 3(4H)- yl)acetamide
Smiles: O=C(Cn1cnc2c(c1=O)cccc2)Nc1ccc(c(c1)F)F

STK576209
Synonyms: 3- [(2- bromo- 4- nitrophenyl)amino]- 2- benzofuran- 1(3H)- one
Smiles: Brc1cc(ccc1NC1OC(=O)c2c1cccc2)[N+](=O)[O-]

STK848570
Synonyms: 2,8,10- trimethyl- N- (2- methylpropyl)pyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidin- 4- amine
Smiles: CC(CNc1cc(C)nc2n1nc1c2c(C)cc(n1)C)C

STK576211
Synonyms: 5- [(4- ethenylbenzyl)oxy]- 2- [4- phenyl- 3- (trifluoromethyl)- 1H- pyrazol- 5- yl]phenol
Smiles: C=Cc1ccc(cc1)COc1ccc(c(c1)O)c1[nH]nc(c1c1ccccc1)C(F)(F)F

STK576212
Synonyms: 2- (2- bromo- 5- chloro- 6- methyl- 1- benzofuran- 3- yl)acetamide
Smiles: NC(=O)Cc1c(Br)oc2c1cc(Cl)c(c2)C

STK576215
Synonyms: 7- hydroxy- 5- (4- hydroxyphenyl)- 2- (methylsulfanyl)- 5,6- dihydropyrido[2,3- d]pyrimidin- 4(3H)- one
Smiles: CSc1nc2N=C(O)CC(c2c(=O)[nH]1)c1ccc(cc1)O

STK576218
Synonyms: (4Z)- 4- (1,3- benzodioxol- 5- ylmethylidene)- 2- (2- chlorophenyl)- 4H- imidazol- 5- ol
Smiles: OC1=NC(=N/C/1=C\c1ccc2c(c1)OCO2)c1ccccc1Cl

STK576221
Synonyms: 3- (2- hydroxy- 3,5- dimethylphenyl)- 4- phenyl- 5- (pyridin- 3- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: Cc1cc(C)c(c(c1)c1[nH]nc2c1C(c1ccccc1)N(C2=O)Cc1cccnc1)O

STK576224
Synonyms: 1'- (4- chlorophenyl)- 3- ethyl- 2'- hydroxy- 8- nitro- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: CCN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)c1ccc(cc1)Cl)O

STK576235
Synonyms: 2- amino- 6- hydroxy- 5- (4- propoxyphenyl)- 3,5- dihydro- 4H- indeno[2',1':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CCCOc1ccc(cc1)C1C2=C(O)c3c(C2=Nc2c1c(=O)[nH]c(n2)N)cccc3

STK576237
Synonyms: ethyl(2E)- 2- {[(2Z)- 2- cyano- 3- (4- methoxyphenyl)prop- 2- enoyl]imino}- 4- methyl- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: CCOC(=O)c1s/c(=N/C(=O)/C(=C\c2ccc(cc2)OC)/C#N)/[nH]c1C

STK848573
Synonyms: 2- {2- [(2- methyl- 3- phenyl- 6,7- dihydro- 5H- cyclopenta[d]pyrazolo[1,5- a]pyrimidin- 8- yl)amino]ethoxy}ethanol
Smiles: OCCOCCNc1c2CCCc2nc2n1nc(c2c1ccccc1)C

STK576242
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 5- [2- (3,4- dimethoxyphenyl)ethyl]- 4- (3- hydroxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1cc(CCN2C(=O)c3c(C2c2cccc(c2)O)c([nH]n3)c2cc(Cl)c(cc2O)C)ccc1OC

STK848575
Synonyms: 2- ethyl- 5,7- dimethyl- 3- phenylpyrazolo[1,5- a]pyrimidine
Smiles: CCc1nn2c(c1c1ccccc1)nc(cc2C)C

STK576248
Synonyms: (6E)- 6- [2- (4- fluorophenyl)hydrazinylidene]- 6- (pyridin- 2- yl)hexanoicacid
Smiles: OC(=O)CCCC/C(=N\Nc1ccc(cc1)F)/c1ccccn1

STK848576
Synonyms: N- [4- (3,4- dimethoxyphenyl)- 1,2,5- oxadiazol- 3- yl]- 2- (2- fluorophenoxy)propanamide
Smiles: COc1cc(ccc1OC)c1nonc1NC(=O)C(Oc1ccccc1F)C

STK576250
Synonyms: 4- chloro- 5- [(2E)- 2- (pyridin- 2- ylmethylidene)hydrazinyl]pyridazin- 3- ol
Smiles: Oc1nncc(c1Cl)N/N=C/c1ccccn1

STK576252
Synonyms: (3R)- N- [2- (3- fluorophenyl)ethyl]- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: Fc1cccc(c1)CCNC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

STK576253
Synonyms: 6- amino- 3- (4- fluorophenyl)- 4- (3,4,5- trimethoxyphenyl)- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc(OC)c(c(c1)OC)OC)c([nH]n2)c1ccc(cc1)F

STK576255
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)Nc1ccccc1CC)C

STK576259
Synonyms: 6- chloro- N- {3- [(furan- 2- ylmethyl)carbamoyl]- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl}- 7- methyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cc(c(c2)Cl)C)Nc1sc2c(c1C(=O)NCc1ccco1)CCCC2

STK576260
Synonyms: 4- methyl- 10'H- spiro[cyclohexane- 1,4'- [1,3,5]triazino[1,2- a]benzimidazol]- 2'- amine
Smiles: CC1CCC2(CC1)N=C(N)N=c1n2c2ccccc2[nH]1

STK576264
Synonyms: 11- (furan- 2- yl)- 10- methyl- 2- (2- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1ccccc1c1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1

STK576266
Synonyms: N- benzyl- 5- (2- hydroxy- 3,5- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1cc(C)c(c(c1)c1[nH]nc(c1)C(=O)NCc1ccccc1)O

STK848579
Synonyms: 8- (4- chlorophenyl)- 6- oxo- 3- phenyl- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)Cl)c1ccccc1

STK848580
Synonyms: ethyl(7- hydroxy- 2- methyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 5- yl)acetate
Smiles: CCOC(=O)Cc1cc(O)n2c(n1)c(c1ccccc1)c(n2)C

STK848581
Synonyms: N- methyl- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]methanesulfonamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(S(=O)(=O)C)C

STK848582
Synonyms: 2- (4- fluorophenyl)pyrimido[1,2- a]benzimidazol- 4- ol
Smiles: Fc1ccc(cc1)c1cc(O)n2c(n1)nc1c2cccc1

STK576272
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (3,4- dichlorophenyl)- 5- (pyridin- 3- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: O=C1N(Cc2cccnc2)C(c2c1n[nH]c2c1cc(Cl)c(cc1O)C)c1ccc(c(c1)Cl)Cl

STK576274
Synonyms: N- [3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanoyl]- L- phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)CCn1nnc2c(c1=O)cccc2

STK848583
Synonyms: 3- (3,4- dimethoxyphenyl)- 2,5- dimethyl- 7- (pyrrolidin- 1- yl)pyrazolo[1,5- a]pyrimidine
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)cc2N1CCCC1

STK576278
Synonyms: 5- propyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCCc1cc(O)n2c(n1)ncn2

STK576281
Synonyms: 5- [(2,5- dimethylbenzyl)oxy]- 2- [4- (2- methoxyphenoxy)- 3- methyl- 1H- pyrazol- 5- yl]phenol
Smiles: COc1ccccc1Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1cc(C)ccc1C

STK576284
Synonyms: 3- (5,11- dimethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)propanoicacid
Smiles: OC(=O)CCc1nn2c(n1)c1c(nc2C)sc2c1C(C)CCC2

STK848587
Synonyms: 5- ethoxy- 2- [4- (4- methoxyphenyl)- 3- (trifluoromethyl)- 1,2- oxazol- 5- yl]phenol
Smiles: CCOc1ccc(c(c1)O)c1onc(c1c1ccc(cc1)OC)C(F)(F)F

STK576288
Synonyms: 2- (ethylsulfanyl)- 6,6- dimethyl- 9- (thiophen- 2- yl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CC(C1)(C)C)C2c1cccs1

STK576292
Synonyms: 2- hydroxy- 5- [({4- [(E)- (3- methyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]phenyl}carbonyl)amino]benzoicacid
Smiles: S=C1S/C(=C/c2ccc(cc2)C(=O)Nc2ccc(c(c2)C(=O)O)O)/C(=O)N1C

STK576298
Synonyms: N- [1- (4- fluorophenyl)- 4- hydroxy- 2,6- dioxo- 5- (trifluoromethyl)- 2,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]furan- 2- carboxamide
Smiles: Fc1ccc(cc1)n1c(=O)nc(c2c1NC(=O)C2(NC(=O)c1ccco1)C(F)(F)F)O

STK848591
Synonyms: 6- chloro- N- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: N#Cc1c(NC(=O)c2cc(=O)c3c(o2)ccc(c3)Cl)sc2c1CCCC2

STK576299
Synonyms: 2- (2- hydroxyphenyl)- 9,9- dimethyl- 12- (pyridin- 3- yl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: O=C1CC(C)(C)CC2=C1C(c1cccnc1)c1c(O2)ncn2c1nc(n2)c1ccccc1O

STK576301
Synonyms: N- [(3,5- dimethoxyphenyl)carbamoyl]- L- valine
Smiles: COc1cc(NC(=O)N[C@H](C(=O)O)C(C)C)cc(c1)OC

STK576305
Synonyms: 7- (4- chlorophenyl)- 3- (4- ethylphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCc1ccc(cc1)c1nnc2n1cnc1c2cnn1c1ccc(cc1)Cl

STK848592
Synonyms: 8- benzyl- 1,6,7- trimethyl- 3- (2- methylprop- 2- en- 1- yl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)Cc1ccccc1

STK576308
Synonyms: (4Z)- 4- (hydroxyimino)- 3,6,6- trimethyl- N- (pyridin- 3- yl)- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O/N=C\1/CC(C)(C)Cc2c1c(C)c(o2)C(=O)Nc1cccnc1

STK576310
Synonyms: 12- (furan- 2- yl)- 9,9- dimethyl- 2- (thiophen- 2- yl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1cccs1

STK576316
Synonyms: (4E)- 4- [(1- {2- hydroxy- 3- [(3- methoxyphenyl)amino]propyl}- 1H- indol- 3- yl)methylidene]- 5- methyl- 2- phenyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: COc1cccc(c1)NCC(Cn1cc(c2c1cccc2)/C=C/1\C(=NN(C1=O)c1ccccc1)C)O

STK576321
Synonyms: 4- [(4- benzylpiperidin- 1- yl)methyl]- 6- methyl- 2H- chromen- 2- one
Smiles: Cc1ccc2c(c1)c(CN1CCC(CC1)Cc1ccccc1)cc(=O)o2

STK576323
Synonyms: N- [9- (methylsulfanyl)- 4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl]butane- 1,4- diamine
Smiles: NCCCCNc1nc(SC)nc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK576331
Synonyms: [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl](5- methoxy- 3- methyl- 1H- indol- 2- yl)methanone
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK848597
Synonyms: [3- (benzylamino)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl](4- fluorophenyl)methanone
Smiles: Fc1ccc(cc1)C(=O)n1c(NCc2ccccc2)n[nH]c1=S

STK576338
Synonyms: 3- {(2S)- 1- [4- (3- chlorophenyl)piperazin- 1- yl]- 3- methyl- 1- oxobutan- 2- yl}quinazolin- 4(3H)- one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)[C@@H](n1cnc2c(c1=O)cccc2)C(C)C

STK576342
Synonyms: 3- {[(4- fluorophenyl)sulfonyl]amino}- 1H- indole- 2- carboxylicacid
Smiles: Fc1ccc(cc1)S(=O)(=O)Nc1c([nH]c2c1cccc2)C(=O)O

STK576344
Synonyms: 6- chloro- 1- hydroxy- 9- oxo- 9H- xanthen- 3- yl4- [(tert- butoxycarbonyl)amino]butanoate
Smiles: O=C(Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl)CCCNC(=O)OC(C)(C)C

STK576347
Synonyms: N- (2- bromophenyl)- 4- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanamide
Smiles: O=C(Nc1ccccc1Br)CCCn1nnc2c(c1=O)cccc2

STK576348
Synonyms: 5- (2- hydroxy- 3,5- dimethylphenyl)- N- (4- methylbenzyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(cc1)CNC(=O)c1n[nH]c(c1)c1cc(C)cc(c1O)C

STK576351
Synonyms: 6- [(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methyl]- N- phenyl- 1,3,5- triazine- 2,4- diamine
Smiles: COc1cc2CCN(Cc2cc1OC)Cc1nc(N)nc(n1)Nc1ccccc1

STK848600
Synonyms: N'- [(E)- (2- chloro- 6- fluorophenyl)methylidene]- 5- (propan- 2- yl)- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)C(C)C)N/N=C/c1c(F)cccc1Cl

STK576355
Synonyms: 8- (4- ethylpiperazin- 1- yl)- 6- hydroxy- 7- [2- (4- methoxyphenyl)ethyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCN1CCN(CC1)c1nc2c(n1CCc1ccc(cc1)OC)c(O)nc(=O)n2C

STK576359
Synonyms: 5- chloro- N- [(2Z)- 3- chloroquinoxalin- 2(1H)- ylidene]thiophene- 2- sulfonamide
Smiles: Clc1ccc(s1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Cl

STK576361
Synonyms: 2,2- dichloro- N- [(2Z)- 6- (methylsulfonyl)- 1,3- benzothiazol- 2(3H)- ylidene]acetamide
Smiles: O=C(C(Cl)Cl)/N=c/1\sc2c([nH]1)ccc(c2)S(=O)(=O)C

STK848606
Synonyms: (2Z)- 3- oxo- 2- (pyridin- 3- ylmethylidene)- 7- (pyrrolidinium- 1- ylmethyl)- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: O=C1/C(=C/c2cccnc2)/Oc2c1ccc(c2C[NH+]1CCCC1)[O-]

STK576367
Synonyms: 5- [(2- chloro- 4- fluorobenzyl)oxy]- 2- (3- methyl- 4- phenyl- 1H- pyrazol- 5- yl)phenol
Smiles: Fc1ccc(c(c1)Cl)COc1ccc(c(c1)O)c1[nH]nc(c1c1ccccc1)C

STK848607
Synonyms: 1- benzyl- 4- oxo- N- (tetrahydrofuran- 2- ylmethyl)- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: O=c1c2cc(n(c2nc2n1cccc2)Cc1ccccc1)C(=O)NCC1CCCO1

STK576369
Synonyms: N- [2- methyl- 5- (6- methyl[1,2,4]triazolo[3,4- a]phthalazin- 3- yl)benzyl]propanamide
Smiles: CCC(=O)NCc1cc(ccc1C)c1nnc2n1nc(C)c1c2cccc1

STK848608
Synonyms: 4- [7- (3- methylphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]phenol
Smiles: Oc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1cccc(c1)C

STK576376
Synonyms: 3- ethyl- 6- phenylthieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: CCn1cnc2c(c1=O)cc(s2)c1ccccc1

STK848609
Synonyms: 2- ({(2Z)- 2- [(5- methylfuran- 2- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetohydrazide
Smiles: NNC(=O)COc1ccc2c(c1)O/C(=C\c1ccc(o1)C)/C2=O

STK848610
Synonyms: 6- (3,4- dimethoxyphenyl)- N- (4- fluorophenyl)- 2- hydroxy- 4- methyl- 1,6- dihydropyrimidine- 5- carboxamide
Smiles: COc1cc(ccc1OC)C1NC(=NC(=C1C(=O)Nc1ccc(cc1)F)C)O

STK576380
Synonyms: N- [3- (4- chlorophenyl)- 4- oxo- 4H- chromen- 2- yl]benzamide
Smiles: Clc1ccc(cc1)c1c(NC(=O)c2ccccc2)oc2c(c1=O)cccc2

STK576381
Synonyms: N- (3- cyanophenyl)- 2- (7- methyl- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)acetamide
Smiles: N#Cc1cccc(c1)NC(=O)CN1CCc2c(C1C)cc1c(c2)OCCCO1

STK576383
Synonyms: 2- [4- (4- bromophenyl)- 3- (trifluoromethyl)- 1H- pyrazol- 5- yl]- 5- methoxyphenol
Smiles: COc1ccc(c(c1)O)c1[nH]nc(c1c1ccc(cc1)Br)C(F)(F)F

STK848613
Synonyms: 1- benzyl- N- (2- chlorophenyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: Clc1ccccc1NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK576385
Synonyms: N,N- diethyl- 2- [7- (furan- 2- yl)- 8- imino- 7H- benzo[7,8]chromeno[2,3- d]pyrimidin- 9(8H)- yl]ethanamine
Smiles: CCN(CCn1cnc2c(c1=N)C(c1ccco1)c1c(O2)c2ccccc2cc1)CC

STK576390
Synonyms: 4- [(1E)- 2- cyano- 3- methoxy- 3- oxoprop- 1- en- 1- yl]- 2- methoxyphenyl4- bromobenzoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1ccc(cc1)Br)/C(=O)OC

STK576399
Synonyms: 1- (3- ethoxyphenyl)- 2,7- dimethyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cccc(c1)C1N(C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK576404
Synonyms: (3S)- N- [(2S)- 1- (cyclohexylamino)- 4- (methylsulfanyl)- 1- oxobutan- 2- yl]- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: CSCC[C@@H](C(=O)NC1CCCCC1)NC(=O)[C@H]1NCc2c(C1)cccc2

STK576410
Synonyms: 3- (3- chlorophenyl)- 2- {[2- (dimethylamino)ethyl]amino}- 7- methyl- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: CN(CCNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C)C

STK576411
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 5- (2- hydroxy- 3,5- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: COc1ccc(cc1OC)CCNC(=O)c1n[nH]c(c1)c1cc(C)cc(c1O)C

STK848614
Synonyms: 2- methyl- 3- phenyl- 9- (4- phenylpiperazin- 1- yl)- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazoline
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2N2CCN(CC2)c2ccccc2)CCCC1

STK576413
Synonyms: 5,7- diethylbenzimidazo[1',2':1,6]pyrimido[4,5- b]quinolin- 14(5H)- one
Smiles: CCc1nc2n(CC)c3ccccc3c(=O)c2c2n1c1ccccc1n2

STK576415
Synonyms: 7- ethyl- 8- (4- ethylphenoxy)- 3,4- dihydro- 2H,6H- pyrimido[2,1- b][1,3]thiazin- 6- one
Smiles: CCc1c(Oc2ccc(cc2)CC)nc2n(c1=O)CCCS2

STK576420
Synonyms: 4- chloro- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- phenylbenzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(c1ccccc1)Cc1cc2cccc(c2[nH]c1=O)C

STK576422
Synonyms: 5- methyl- 2- (4- methylphenyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1ccc(cc1)c1nc2n(n1)c(O)cc(n2)C

STK576430
Synonyms: 7'- [(Z)- (1- ethyl- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trione
Smiles: CCN1C(=NC(=O)/C(=C/c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)S

STK576433
Synonyms: 9- [4- (diphenylmethyl)piperazin- 1- yl]- 2- methyl- 3- phenyl- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazoline
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2N2CCN(CC2)C(c2ccccc2)c2ccccc2)CCCC1

STK848616
Synonyms: 3- (3,4- dimethoxyphenyl)- 2,5- dimethylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)cc2O

STK576438
Synonyms: (3R)- N- {(2S)- 1- [(2- methoxyethyl)amino]- 4- methyl- 1- oxopentan- 2- yl}- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: COCCNC(=O)[C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)CC(C)C

STK576442
Synonyms: 5- (2- hydroxy- 3,5- dimethylphenyl)- N- {4- [methyl(phenyl)sulfamoyl]phenyl}- 1H- pyrazole- 3- carboxamide
Smiles: Cc1cc(C)c(c(c1)c1[nH]nc(c1)C(=O)Nc1ccc(cc1)S(=O)(=O)N(c1ccccc1)C)O

STK576445
Synonyms: 3- [azido(phenyl)methyl]quinoxalin- 2- ol
Smiles: [N-]=[N+]=NC(c1nc2ccccc2nc1O)c1ccccc1

STK576451
Synonyms: 4- (4- tert- butylphenyl)- 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 5- (pyridin- 3- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: O=C1N(Cc2cccnc2)C(c2c1n[nH]c2c1cc(Cl)c(cc1O)C)c1ccc(cc1)C(C)(C)C

STK576458
Synonyms: 4- (4- chlorophenyl)- 2,6- dimethylpyridazino[3',4':4,5]pyrimido[1,6- a]benzimidazol- 1(4H)- one
Smiles: Clc1ccc(cc1)n1nc(C)c(=O)c2c1nc(C)n1c2nc2c1cccc2

STK576460
Synonyms: 5- [(3- chlorobenzyl)oxy]- 2- [4- (4- methoxyphenoxy)- 1H- pyrazol- 3- yl]phenol
Smiles: COc1ccc(cc1)Oc1c[nH]nc1c1ccc(cc1O)OCc1cccc(c1)Cl

STK576462
Synonyms: 2,4- bis(3,5- dimethyl- 1H- pyrazol- 1- yl)- 6- phenylpyrimidine
Smiles: Cc1nn(c(c1)C)c1cc(nc(n1)n1nc(cc1C)C)c1ccccc1

STK576464
Synonyms: 6- amino- 5- (1,3- benzothiazol- 2- ylsulfanyl)- 1- ethyl- 4- hydroxypyrimidin- 2(1H)- one
Smiles: CCn1c(=O)nc(c(c1N)Sc1nc2c(s1)cccc2)O

STK848620
Synonyms: N- (4- ethoxyphenyl)- 2- methyl- 3- phenyl- 6,7- dihydro- 5H- cyclopenta[d]pyrazolo[1,5- a]pyrimidin- 8- amine
Smiles: CCOc1ccc(cc1)Nc1c2CCCc2nc2n1nc(c2c1ccccc1)C

STK848621
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)NC1CCS(=O)(=O)C1

STK576473
Synonyms: (2'S,3R,7a'S)- N- (4- methoxyphenyl)- 5,7- dimethyl- 2- oxo- 1,1',2,2',5',6',7',7a'- octahydrospiro[indole- 3,3'- pyrrolizine]- 2'- carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@H]2N([C@@]31C(=O)Nc1c3cc(C)cc1C)CCC2

STK576476
Synonyms: 5- (2- hydroxy- 4,5- dimethylphenyl)- N- {3- [(2- methoxyethyl)carbamoyl]- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl}- 1H- pyrazole- 3- carboxamide
Smiles: COCCNC(=O)c1c(NC(=O)c2n[nH]c(c2)c2cc(C)c(cc2O)C)sc2c1CCCC2

STK576479
Synonyms: 3- (3- methylbutyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CC(CCn1cnc2c(c1=O)[nH]c1c2cccc1)C

STK576480
Synonyms: N- (heptan- 2- ylcarbamoyl)- D- valine
Smiles: CCCCCC(NC(=O)N[C@@H](C(=O)O)C(C)C)C

STK848622
Synonyms: 2- (3- hydroxy- 2H- 1,4- benzothiazin- 2- yl)- N- (2- methoxy- 4- nitrophenyl)acetamide
Smiles: COc1cc(ccc1NC(=O)CC1Sc2ccccc2N=C1O)[N+](=O)[O-]

STK576481
Synonyms: N- (3- bromobenzyl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- (propan- 2- yloxy)benzamide
Smiles: CC(Oc1ccc(cc1)C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Br)C

STK576489
Synonyms: 2- (3- hydroxypropyl)- 1- phenyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: OCCCN1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)cccc1

STK576491
Synonyms: (2Z)- 2- [(4- fluorophenyl)imino]- 4,7- dimethyl- 2,6,7,8- tetrahydroquinazolin- 5(1H)- one
Smiles: CC1CC(=O)c2c(C1)[nH]/c(=N/c1ccc(cc1)F)/nc2C

STK576501
Synonyms: N- [1- hydrazinyl- 3- (1H- indol- 3- yl)- 1- oxopropan- 2- yl]- 4- methoxybenzamide(non- preferredname)
Smiles: NNC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)c1ccc(cc1)OC

STK576506
Synonyms: N- [5- hydroxy- 2- (phenoxymethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 3- phenylpropanamide
Smiles: O=C(Nc1cc(O)nc2n1nc(n2)COc1ccccc1)CCc1ccccc1

STK576507
Synonyms: 8- ethoxy- 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CCOc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C

STK848624
Synonyms: (2Z)- 3- oxo- 2- (2,3,4- trimethoxybenzylidene)- 2,3- dihydro- 1- benzofuran- 6- yl4- methoxybenzenesulfonate
Smiles: COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(c(c1OC)OC)OC)/C2=O

STK576512
Synonyms: 2- [(7,7- dimethyl- 2- phenyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl)sulfanyl]- N- (4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK576515
Synonyms: 3- butyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCn1cnc2c(c1=O)[nH]c1c2cccc1

STK576516
Synonyms: 1- (1- {6- [(4- chlorophenyl)amino]pyrimidin- 4- yl}- 5- methyl- 1H- pyrazol- 4- yl)ethanone
Smiles: Clc1ccc(cc1)Nc1ncnc(c1)n1ncc(c1C)C(=O)C

STK576517
Synonyms: N- {[3- (acetylamino)phenyl]carbamoyl}- L- phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)Nc1cccc(c1)NC(=O)C

STK576520
Synonyms: 5- (furan- 2- ylmethyl)- 3- (2- hydroxy- 3,5- dimethylphenyl)- 4- (3- hydroxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: Oc1cccc(c1)C1N(Cc2ccco2)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C

STK576521
Synonyms: 6- ethyl- 3- (3- fluorophenyl)- 10- methyl- 3,4- dihydro- 2H,8H- chromeno[6,7- e][1,3]oxazin- 8- one
Smiles: CCc1cc(=O)oc2c1cc1CN(COc1c2C)c1cccc(c1)F

STK576522
Synonyms: 1- methyl- 4- (2- methylphenyl)piperidine- 4- carbonitrile
Smiles: N#CC1(CCN(CC1)C)c1ccccc1C

STK576524
Synonyms: 2- [(3- hydroxypropyl)amino]- 3- (4- methoxyphenyl)- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: OCCCNc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCCCC3

STK576527
Synonyms: (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)(9H- fluoren- 9- yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)C1c2ccccc2c2c1cccc2

STK576529
Synonyms: 5,6- dimethyl- N- (pyridin- 2- yl)- 7- (pyridin- 3- yl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1n(c2cccnc2)c2c(c1C)c(ncn2)Nc1ccccn1

STK576531
Synonyms: 1- (3,4- dimethoxyphenyl)- 2- methyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(ccc1OC)C1N(C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK848630
Synonyms: 2- [2- amino- 5- (2- methoxyphenyl)pyrimidin- 4- yl]- 5- [(4- fluorobenzyl)oxy]phenol
Smiles: COc1ccccc1c1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1)F)N

STK576533
Synonyms: 4- [(4- methylphenyl)carbonyl]- 2- [3- (trifluoromethyl)phenyl]hexahydropyrrolo[3,4- a]pyrrolizine- 1,3(2H,4H)- dione
Smiles: Cc1ccc(cc1)C(=O)C1N2CCCC2C2C1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F

STK848631
Synonyms: 3- (2- methoxyphenyl)- 8- [4- (methylsulfanyl)phenyl]- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)SC)c1ccccc1OC

STK848633
Synonyms: 4- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- phenylbutanamide
Smiles: O=C(Nc1ccccc1)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK576536
Synonyms: N- [(2E)- 3- [2- (4- fluorophenyl)ethyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 3- methylbutanamide
Smiles: CC(CC(=O)/N=C\1/SC2C(N1CCc1ccc(cc1)F)CS(=O)(=O)C2)C

STK576538
Synonyms: 6- [(2,6- dimethylmorpholin- 4- ium- 4- yl)methyl]- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- olate
Smiles: CC1C[NH+](CC(O1)C)Cc1c([O-])ccc2c1oc(=O)c1c2CCC1

STK576540
Synonyms: (2Z)- 2- (4- ethylbenzylidene)- 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(cc1)CC)/C2=O

STK576542
Synonyms: N- [2- (3,4- dihydroxyphenyl)ethyl]- 3- [(5E)- 5- (4- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(CCN1C(=S)S/C(=C/c2ccc(cc2)F)/C1=O)NCCc1ccc(c(c1)O)O

STK576543
Synonyms: 10,10- dimethyl- 2- (3- methylphenyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1cccc(c1)c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK576544
Synonyms: methyl{8- [(4- carbamoylpiperidin- 1- yl)methyl]- 1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl}acetate
Smiles: COC(=O)Cn1c(CN2CCC(CC2)C(=O)N)nc2c1c(=O)n(c(=O)n2C)C

STK576551
Synonyms: 2- [4- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 5- [(4- fluorobenzyl)oxy]phenol
Smiles: Fc1ccc(cc1)COc1ccc(c(c1)O)c1n[nH]cc1c1ccc(cc1)Cl

STK848637
Synonyms: 1- benzyl- 9- methyl- 2- (piperidin- 1- ylcarbonyl)pyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=C(c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C)N1CCCCC1

STK576553
Synonyms: N- (2- chlorophenyl)- 4- (4- chlorophenyl)- 1- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Cc1ccc(cc1)c1c(C(=O)Nc2ccccc2Cl)n2c3c1CCCCn3c(c2)c1ccc(cc1)Cl

STK576554
Synonyms: 6- ethyl- 4- {[4- (2- fluorophenyl)piperazin- 1- yl]methyl}- 2H- chromen- 2- one
Smiles: CCc1ccc2c(c1)c(CN1CCN(CC1)c1ccccc1F)cc(=O)o2

STK576555
Synonyms: N- [3- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)propanoyl]glycyl- N- [(trans- 4- carboxycyclohexyl)methyl]glycinamide
Smiles: O=C(NCC(=O)NC[C@@H]1CC[C@H](CC1)C(=O)O)CNC(=O)CCc1c(=O)oc2c(c1C)ccc(c2)O

STK576557
Synonyms: 8- benzyl- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidine
Smiles: O1CCN(CC1)c1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1

STK576562
Synonyms: {[(2Z)- 2- (2- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}aceticacid
Smiles: OC(=O)COc1ccc2c(c1)O/C(=C\c1ccccc1F)/C2=O

STK576563
Synonyms: N- (6- chloro- 4- oxo- 3- phenyl- 4H- chromen- 2- yl)furan- 2- carboxamide
Smiles: Clc1ccc2c(c1)c(=O)c(c(o2)NC(=O)c1ccco1)c1ccccc1

STK576564
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (3- hydroxyphenyl)- 5- (4- methoxybenzyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)CN1C(=O)c2c(C1c1cccc(c1)O)c([nH]n2)c1cc(Cl)c(cc1O)C

STK576566
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)Nc1ccc(cc1)CC)C

STK576568
Synonyms: 2- (7,8- dimethoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (2- methoxyethyl)acetamide
Smiles: COCCNC(=O)Cc1c(=O)oc2c(c1C)ccc(c2OC)OC

STK576569
Synonyms: 5- [(4- ethenylbenzyl)oxy]- 2- [5- phenyl- 6- (trifluoromethyl)pyrimidin- 4- yl]phenol
Smiles: C=Cc1ccc(cc1)COc1ccc(c(c1)O)c1ncnc(c1c1ccccc1)C(F)(F)F

STK576572
Synonyms: 5- (2- hydroxy- 4- methylphenyl)- N- {3- [(2- methoxyethyl)carbamoyl]- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl}- 1H- pyrazole- 3- carboxamide
Smiles: COCCNC(=O)c1c(NC(=O)c2n[nH]c(c2)c2ccc(cc2O)C)sc2c1CCCC2

STK576573
Synonyms: N'- [(E)- (3- hydroxy- 4- methoxyphenyl)methylidene]- 4- methoxy- 1H- indole- 2- carbohydrazide
Smiles: COc1ccc(cc1O)/C=N/NC(=O)c1cc2c([nH]1)cccc2OC

STK576576
Synonyms: (3R,3'S,3a'S,6a'R)- 5'- (2- fluorophenyl)- 3'- (propan- 2- yl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CC([C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1F)C(=O)Nc1c2cccc1)C

STK576577
Synonyms: N- [(4- fluorophenyl)carbamoyl]- L- phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)Nc1ccc(cc1)F

STK576585
Synonyms: 1- (4- hydroxy- 3- methoxyphenyl)- 5,7- dimethyl- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(ccc1O)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)c(C)cc(c1)C

STK576587
Synonyms: 2- {[4- (diethylamino)phenyl]amino}- 9,10- dimethoxy- 6,7- dihydro- 4H- pyrimido[6,1- a]isoquinolin- 4- one
Smiles: CCN(c1ccc(cc1)Nc1nc(=O)n2c(c1)c1cc(OC)c(cc1CC2)OC)CC

STK576588
Synonyms: 3- [(5E)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)propanamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)CCN1C(=S)S/C(=C/c2ccccc2)/C1=O

STK848642
Synonyms: 2- [(2,4- dichlorophenyl)amino]- 6- methyl- 5- (3- methylbutyl)pyrimidin- 4- ol
Smiles: CC(CCc1c(C)nc(nc1O)Nc1ccc(cc1Cl)Cl)C

STK576590
Synonyms: (3S)- N- [4- (propan- 2- yl)phenyl]- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: O=C([C@H]1NCc2c(C1)cccc2)Nc1ccc(cc1)C(C)C

STK576591
Synonyms: N- [(3- hydroxypyridin- 2- yl)carbamothioyl]- 2,4- dimethoxybenzamide
Smiles: COc1cc(OC)ccc1C(=O)NC(=S)Nc1ncccc1O

STK848643
Synonyms: N- [(2Z)- 6- methyl- 1,3- benzothiazol- 2(3H)- ylidene]- 3- (2- oxo- 2H- chromen- 3- yl)benzamide
Smiles: Cc1ccc2c(c1)s/c(=N\C(=O)c1cccc(c1)c1cc3ccccc3oc1=O)/[nH]2

STK576595
Synonyms: 5- methyl- 3- oxo- 1- phenyl- 3,5- dihydropyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#Cc1c(=O)cc(n2c1n(C)c1c2cccc1)c1ccccc1

STK848644
Synonyms: 1- (3- methoxypropyl)- 9- methyl- 4- oxo- N- (prop- 2- en- 1- yl)- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCC=C

STK848646
Synonyms: 1- (3- methylphenyl)- N- {4- [methyl(phenyl)sulfamoyl]phenyl}- 4- oxo- 1,4- dihydropyridazine- 3- carboxamide
Smiles: Cc1cccc(c1)n1ccc(=O)c(n1)C(=O)Nc1ccc(cc1)S(=O)(=O)N(c1ccccc1)C

STK576600
Synonyms: 5- [(3,4- dichlorobenzyl)oxy]- 2- [5- (4- methoxyphenyl)pyrimidin- 4- yl]phenol
Smiles: COc1ccc(cc1)c1cncnc1c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl

STK576603
Synonyms: 1- {N- [(6- chloro- 7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetyl]glycylglycyl}piperidine- 4- carboxylicacid
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)NCC(=O)NCC(=O)N1CCC(CC1)C(=O)O

STK848649
Synonyms: 3- (4- chlorophenyl)- 5- methyl- 7- (morpholin- 4- yl)pyrazolo[1,5- a]pyrimidine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)cc2N1CCOCC1

STK576612
Synonyms: 3- [(5,6- dimethylthieno[2,3- d]pyrimidin- 4- yl)amino]benzoicacid
Smiles: OC(=O)c1cccc(c1)Nc1ncnc2c1c(C)c(s2)C

STK848654
Synonyms: 5- methoxy- 2- [5- (4- methoxyphenyl)- 6- (trifluoromethyl)pyrimidin- 4- yl]phenol
Smiles: COc1ccc(cc1)c1c(ncnc1C(F)(F)F)c1ccc(cc1O)OC

STK848655
Synonyms: (2Z)- 7- {[bis(2- methoxyethyl)ammonio]methyl}- 3- oxo- 2- (pyridin- 3- ylmethylidene)- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccnc1)/C2=O)CCOC

STK576625
Synonyms: 4- (methylsulfanyl)- 2- [3- (quinolin- 2- yl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]butanoicacid
Smiles: CSCCC(n1c(=S)[nH]nc1c1ccc2c(n1)cccc2)C(=O)O

STK576628
Synonyms: 7- chloro- 1- (3- methoxyphenyl)- 6- methyl- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cccc(c1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK576632
Synonyms: N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)acetamide
Smiles: CC(CN(C(=O)C)Cc1cc2cc(C)ccc2[nH]c1=O)C

STK576634
Synonyms: (4E)- 2- (2,4- dichlorophenyl)- 4- (3,4- dimethoxybenzylidene)- 4H- imidazol- 5- ol
Smiles: COc1cc(ccc1OC)/C=C\1/N=C(N=C1O)c1ccc(cc1Cl)Cl

STK576638
Synonyms: methylN- (morpholin- 4- ylcarbonyl)- L- alaninate
Smiles: COC(=O)[C@@H](NC(=O)N1CCOCC1)C

STK576639
Synonyms: (4- ethylpiperazin- 1- yl)(4,5,6- trimethoxy- 1H- indol- 2- yl)methanone
Smiles: CCN1CCN(CC1)C(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC

STK576641
Synonyms: 1- {5- methyl- 1- [2- phenyl- 6- (propan- 2- yloxy)pyrimidin- 4- yl]- 1H- pyrazol- 4- yl}ethanone
Smiles: CC(Oc1nc(nc(c1)n1ncc(c1C)C(=O)C)c1ccccc1)C

STK576644
Synonyms: N- (pyridin- 2- ylmethyl)- 4,5,6,7- tetrahydro- 2H- indazole- 3- carboxamide
Smiles: O=C(c1[nH]nc2c1CCCC2)NCc1ccccn1

STK576645
Synonyms: 3- (4- fluorophenyl)- 2,6- dihydroxy- 5- (3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)pyrimidin- 4(3H)- one
Smiles: Fc1ccc(cc1)n1c(O)nc(c(c1=O)C1OC(=O)c2c1cccc2)O

STK576649
Synonyms: {[5- tert- butyl- 3- (4- chlorophenyl)- 2- methylpyrazolo[1,5- a]pyrimidin- 7- yl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1cc(nc2n1nc(c2c1ccc(cc1)Cl)C)C(C)(C)C

STK848656
Synonyms: 2- (3- hydroxy- 5- methyl- 4H- pyrazol- 4- yl)- N'- {(E)- [4- (methylsulfanyl)phenyl]methylidene}acetohydrazide
Smiles: CSc1ccc(cc1)/C=N/NC(=O)CC1C(=NN=C1O)C

STK848657
Synonyms: N- (furan- 2- ylmethyl)- 2- methoxy- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: COc1ccccc1C(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)Cc1ccco1

STK576659
Synonyms: 11- (3,4- dimethoxyphenyl)- 2,10- dimethyl- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cc(ccc1OC)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)C)c1ccccc1

STK576665
Synonyms: 2- [(5E)- 5- (3,4- dihydroxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoicacid
Smiles: OC(=O)C(N1C(=S)S/C(=C/c2ccc(c(c2)O)O)/C1=O)C

STK576672
Synonyms: 3- ({7- [3- (dimethylamino)propyl]- 5,6- dimethyl- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl}amino)propan- 1- ol
Smiles: OCCCNc1ncnc2c1c(C)c(n2CCCN(C)C)C

STK576674
Synonyms: N- [4- (acetylamino)phenyl]- 4- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CCCn1cnc2c(c1=O)cccc2