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

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STK771127
Synonyms: N- [5- oxo- 6- (trifluoromethyl)- 2,3,5,6- tetrahydroimidazo[2,1- b][1,3]thiazol- 6- yl]thiophene- 2- carboxamide
Smiles: O=C1N2CCSC2=NC1(NC(=O)c1cccs1)C(F)(F)F

STK771131
Synonyms: 5- methyl- 6- phenylthieno[2,3- d]pyrimidine- 4(3H)- thione
Smiles: Cc1c(sc2c1c(=S)[nH]cn2)c1ccccc1

STK680258
Synonyms: N- [3- (1,3- dioxolan- 2- yl)phenyl]- 3,4- dimethoxybenzamide
Smiles: COc1ccc(cc1OC)C(=O)Nc1cccc(c1)C1OCCO1

STK680260
Synonyms: ethyl5- chloro- 3- {[4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)butanoyl]amino}- 1- benzofuran- 2- carboxylate
Smiles: CCOC(=O)c1oc2c(c1NC(=O)CCCN1C(=O)c3c(C1=O)cccc3)cc(cc2)Cl

STK771134
Synonyms: methyl5- bromo- 3- {[4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)butanoyl]amino}- 1- benzofuran- 2- carboxylate
Smiles: COC(=O)c1oc2c(c1NC(=O)CCCN1C(=O)c3c(C1=O)cccc3)cc(cc2)Br

STK771135
Synonyms: methyl3- {[4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)butanoyl]amino}- 5- methoxy- 1- benzofuran- 2- carboxylate
Smiles: COC(=O)c1oc2c(c1NC(=O)CCCN1C(=O)c3c(C1=O)cccc3)cc(cc2)OC

STK771138
Synonyms: ethyl1- butyl- 5- hydroxy- 2- methyl- 4- (pyrrolidin- 1- ylmethyl)- 1H- indole- 3- carboxylate
Smiles: CCCCn1c(C)c(c2c1ccc(c2CN1CCCC1)O)C(=O)OCC

STK680261
Synonyms: 2- (dimethylamino)ethyl3- nitrobenzoate
Smiles: CN(CCOC(=O)c1cccc(c1)[N+](=O)[O-])C

STK680265
Synonyms: bis[2- (dimethylamino)ethyl]2,6- dimethylbenzo[1,2- b:4,5- b']difuran- 3,7- dicarboxylate
Smiles: CN(CCOC(=O)c1c(C)oc2c1cc1oc(c(c1c2)C(=O)OCCN(C)C)C)C

STK680267
Synonyms: 1- (2- deoxy- 3- O- hexadecanoylpentofuranosyl)- 4- [(phenylcarbonyl)amino]pyrimidin- 2(1H)- one
Smiles: CCCCCCCCCCCCCCCC(=O)OC1CC(OC1CO)n1ccc(nc1=O)NC(=O)c1ccccc1

STK680268
Synonyms: 3- (4- fluorophenyl)- 3- {[(4- methylphenyl)carbonyl]amino}propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)F)NC(=O)c1ccc(cc1)C

STK680270
Synonyms: 3- {[(2,4- dimethoxyphenyl)carbonyl]amino}- 3- (4- propoxyphenyl)propanoicacid
Smiles: CCCOc1ccc(cc1)C(NC(=O)c1ccc(cc1OC)OC)CC(=O)O

STK680272
Synonyms: N- [4- (acetylamino)- 1,2,5- oxadiazol- 3- yl]- 2- (pyrimidin- 2- ylsulfanyl)acetamide
Smiles: O=C(Nc1nonc1NC(=O)C)CSc1ncccn1

STK771143
Synonyms: N- [4- (acetylamino)- 1,2,5- oxadiazol- 3- yl]- 2- (1,3- benzoxazol- 2- ylsulfanyl)acetamide
Smiles: CC(=O)Nc1nonc1NC(=O)CSc1nc2c(o1)cccc2

STK771144
Synonyms: N- [4- (acetylamino)- 1,2,5- oxadiazol- 3- yl]- 2- [(3- amino- 1H- 1,2,4- triazol- 5- yl)sulfanyl]acetamide
Smiles: O=C(Nc1nonc1NC(=O)C)CSc1[nH]nc(n1)N

STK771150
Synonyms: N- (2- methylpropyl)- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydro[1,2,3]triazino[4',5':4,5]thieno[2,3- c]isoquinolin- 8- amine
Smiles: CC(CNc1nnnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)C

STK771153
Synonyms: 4- (3- methylphenyl)- 1- (methylsulfanyl)- 6,7,8,9- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCCC3

STK771157
Synonyms: [4- hydroxy- 6- methyl- 2- (pentylsulfanyl)pyrimidin- 5- yl]aceticacid
Smiles: CCCCCSc1nc(C)c(c(n1)O)CC(=O)O

STK771158
Synonyms: 6- {[4- chloro- 6- (methylamino)- 1,3,5- triazin- 2- yl]oxy}- 2- methylpyridazin- 3(2H)- one
Smiles: CNc1nc(nc(n1)Cl)Oc1ccc(=O)n(n1)C

STK771159
Synonyms: N- (4- fluorophenyl)- 4- phenyltetrahydro- 2H- pyran- 4- carboxamide
Smiles: Fc1ccc(cc1)NC(=O)C1(CCOCC1)c1ccccc1

STK771160
Synonyms: 4- phenyl- N- [3- (trifluoromethyl)phenyl]tetrahydro- 2H- pyran- 4- carboxamide
Smiles: O=C(C1(CCOCC1)c1ccccc1)Nc1cccc(c1)C(F)(F)F

STK680279
Synonyms: 5,7- diethyl- 2- (pyridin- 3- yl)- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CCC12CN3CC(C2=O)(CN(C1)C3c1cccnc1)CC

STK771172
Synonyms: 3,4- dimethylphenyl2- (acetylamino)- 2- deoxy- beta- D- glucopyranoside
Smiles: OC[C@H]1O[C@@H](Oc2ccc(c(c2)C)C)[C@@H]([C@H]([C@@H]1O)O)NC(=O)C

STK680282
Synonyms: 3- {[(2- fluorophenyl)carbonyl]amino}- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NC(=O)c1ccccc1F

STK680283
Synonyms: 3- [(cyclohexylcarbonyl)amino]- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NC(=O)C1CCCCC1

STK680284
Synonyms: 3- [4- (propan- 2- yloxy)phenyl]- 3- [(thiophen- 2- ylacetyl)amino]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NC(=O)Cc1cccs1

STK680285
Synonyms: 3- [(phenylsulfonyl)amino]- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NS(=O)(=O)c1ccccc1

STK680286
Synonyms: 3- ({[4- (acetylamino)phenyl]sulfonyl}amino)- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NS(=O)(=O)c1ccc(cc1)NC(=O)C

STK680287
Synonyms: 3- ({[4- (acetylamino)phenyl]sulfonyl}amino)- 3- (4- ethoxyphenyl)propanoicacid
Smiles: CCOc1ccc(cc1)C(NS(=O)(=O)c1ccc(cc1)NC(=O)C)CC(=O)O

STK771177
Synonyms: N~2~,N~2~- diethyl- N~4~,N~4~- diphenyl- 1,3,5- triazine- 2,4,6- triamine
Smiles: CCN(c1nc(N)nc(n1)N(c1ccccc1)c1ccccc1)CC

STK771182
Synonyms: ethyl1- [4- (ethylamino)- 6- (piperidin- 1- yl)- 1,3,5- triazin- 2- yl]- 5- methyl- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1C)c1nc(NCC)nc(n1)N1CCCCC1

STK771183
Synonyms: ethyl1- [4- (dimethylamino)- 6- methoxy- 1,3,5- triazin- 2- yl]- 5- phenyl- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccccc1)c1nc(OC)nc(n1)N(C)C

STK771185
Synonyms: N- butyl- 4,6- dimethyl- 3- (1H- pyrrol- 1- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: CCCCNC(=O)c1sc2c(c1n1cccc1)c(C)cc(n2)C

STK771188
Synonyms: N- cyclohexyl- 4- (methoxymethyl)- 6- methyl- 3- (1H- pyrrol- 1- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COCc1cc(C)nc2c1c(n1cccc1)c(s2)C(=O)NC1CCCCC1

STK771189
Synonyms: 3- amino- 4- (methoxymethyl)- 6- methyl- N- [2- (trifluoromethyl)phenyl]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COCc1cc(C)nc2c1c(N)c(s2)C(=O)Nc1ccccc1C(F)(F)F

STK771194
Synonyms: 2- chloro- N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]benzenesulfonamide
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2ccccc2Cl)nc(n1)c1ccccc1

STK680297
Synonyms: 1- {1- [4- (dimethylamino)- 6- ethoxy- 1,3,5- triazin- 2- yl]- 5- methyl- 1H- 1,2,3- triazol- 4- yl}ethanone
Smiles: CCOc1nc(nc(n1)n1nnc(c1C)C(=O)C)N(C)C

STK680298
Synonyms: methyl(3Z)- 3- (3,3- dimethyl- 3,4- dihydroisoquinolin- 1(2H)- ylidene)- 2- oxopropanoate
Smiles: COC(=O)C(=O)/C=C/1\NC(C)(C)Cc2c1cccc2

STK680299
Synonyms: 2,4- dichloro- 5- (dimethylsulfamoyl)- N- {2- [2- methyl- 7- (trifluoromethyl)- 1H- indol- 3- yl]ethyl}benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)N(C)C)NCCc1c(C)[nH]c2c1cccc2C(F)(F)F

STK680300
Synonyms: 2,4- dichloro- N- [2- (7- chloro- 2- methyl- 1H- indol- 3- yl)ethyl]- 5- (dimethylsulfamoyl)benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)N(C)C)NCCc1c(C)[nH]c2c1cccc2Cl

STK680302
Synonyms: 3- {[(4- methylphenyl)carbonyl]amino}- 3- (4- propoxyphenyl)propanoicacid
Smiles: CCCOc1ccc(cc1)C(NC(=O)c1ccc(cc1)C)CC(=O)O

STK680303
Synonyms: N- [4- (acetylamino)- 1,2,5- oxadiazol- 3- yl]- 2- [(4- hydroxypyrimidin- 2- yl)sulfanyl]acetamide
Smiles: O=C(Nc1nonc1NC(=O)C)CSc1nccc(n1)O

STK771198
Synonyms: N- [4- (acetylamino)- 1,2,5- oxadiazol- 3- yl]- 2- (4,5- dihydro- 1,3- thiazol- 2- ylsulfanyl)acetamide
Smiles: O=C(Nc1nonc1NC(=O)C)CSC1=NCCS1

STK680306
Synonyms: 3- [4- (propan- 2- yloxy)phenyl]- 3- [(9H- xanthen- 9- ylcarbonyl)amino]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NC(=O)C1c2ccccc2Oc2c1cccc2

STK680308
Synonyms: 3- {[(4- fluorophenyl)acetyl]amino}- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: CC(Oc1ccc(cc1)C(CC(=O)O)NC(=O)Cc1ccc(cc1)F)C

STK680309
Synonyms: 3- [(benzylsulfonyl)amino]- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NS(=O)(=O)Cc1ccccc1

STK680311
Synonyms: 3- [(4- phenylbutanoyl)amino]- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: O=C(NC(c1ccc(cc1)OC(C)C)CC(=O)O)CCCc1ccccc1

STK680313
Synonyms: 3- (4- ethoxyphenyl)- 3- {[(2- fluorophenyl)carbonyl]amino}propanoicacid
Smiles: CCOc1ccc(cc1)C(NC(=O)c1ccccc1F)CC(=O)O

STK771203
Synonyms: 2- (3,4- dimethoxyphenyl)- 3- hydroxy- 5,7- dimethoxy- 2,3- dihydro- 4H- chromen- 4- one
Smiles: COc1cc2OC(c3ccc(c(c3)OC)OC)C(C(=O)c2c(c1)OC)O

STK680314
Synonyms: (1R,9aR)- octahydro- 2H- quinolizin- 1- ylmethyl[(4- chlorophenoxy)sulfonyl]carbamate
Smiles: O=C(NS(=O)(=O)Oc1ccc(cc1)Cl)OC[C@@H]1CCCN2[C@@H]1CCCC2

STK771204
Synonyms: 1,2- O- cyclohexane- 1,1- diylhexofuranose
Smiles: OCC(C1OC2C(C1O)OC1(O2)CCCCC1)O

STK771206
Synonyms: N- (3- methylpent- 1- yn- 3- yl)- 2- phenylacetamide
Smiles: CCC(NC(=O)Cc1ccccc1)(C#C)C

STK771207
Synonyms: 1- phenyl- 2- (1H- pyrazol- 1- yl)ethanol
Smiles: OC(c1ccccc1)Cn1cccn1

STK771208
Synonyms: 1,1'- [(Z)- 1- phenylethene- 1,2- diyl]bis(1H- pyrazole)
Smiles: c1ccc(cc1)/C(=C/n1cccn1)/n1cccn1

STK771209
Synonyms: 2,4- di(morpholin- 4- yl)- 6- (prop- 2- en- 1- yloxy)- 1,3,5- triazine
Smiles: C=CCOc1nc(nc(n1)N1CCOCC1)N1CCOCC1

STK771211
Synonyms: N- benzyl- 4- (methoxymethyl)- 6- methyl- 3- (1H- pyrrol- 1- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COCc1cc(C)nc2c1c(n1cccc1)c(s2)C(=O)NCc1ccccc1

STK680315
Synonyms: (2E)- 3- amino- 2- [(E)- (4- methylphenyl)diazenyl]- 3- (morpholin- 4- yl)prop- 2- enenitrile
Smiles: N#C/C(=C(\N1CCOCC1)/N)/N=N/c1ccc(cc1)C

STK771214
Synonyms: 5H- indeno[1,2- b]pyridine
Smiles: c1ccc2c(c1)Cc1c2nccc1

STK771215
Synonyms: 1,4- diphenyl- 2- (1H- pyrazol- 1- yl)butane- 1,4- dione
Smiles: O=C(c1ccccc1)CC(C(=O)c1ccccc1)n1cccn1

STK771218
Synonyms: 2- (2- methoxyethyl)- 2,8- diazaspiro[5.5]undecane- 1,3,9- trione
Smiles: COCCN1C(=O)CCC2(C1=O)CCC(=O)NC2

STK680319
Synonyms: (3E)- 4- [(2,3,6- trimethyl- 1H- indol- 5- yl)amino]pent- 3- en- 2- one
Smiles: C/C(=C\C(=O)C)/Nc1cc2c(cc1C)[nH]c(c2C)C

STK680320
Synonyms: N- [2- (2,5- dimethyl- 1H- indol- 3- yl)ethyl]- 1- (methylsulfonyl)- 2,3- dihydro- 1H- indole- 5- sulfonamide
Smiles: Cc1ccc2c(c1)c(CCNS(=O)(=O)c1ccc3c(c1)CCN3S(=O)(=O)C)c([nH]2)C

STK771220
Synonyms: 2- chloro- N- [2- (2,5- dimethyl- 1H- indol- 3- yl)ethyl]- 4,5- difluorobenzamide
Smiles: Cc1ccc2c(c1)c(CCNC(=O)c1cc(F)c(cc1Cl)F)c([nH]2)C

STK771222
Synonyms: 2- (3,4- diethoxybenzyl)- 5- {4- [(2- fluorobenzyl)oxy]phenyl}- 2H- tetrazole
Smiles: CCOc1cc(ccc1OCC)Cn1nnc(n1)c1ccc(cc1)OCc1ccccc1F

STK771223
Synonyms: 2- (3,4- diethoxybenzyl)- 5- [4- (methylsulfonyl)phenyl]- 2H- tetrazole
Smiles: CCOc1cc(ccc1OCC)Cn1nnc(n1)c1ccc(cc1)S(=O)(=O)C

STK680322
Synonyms: 4- hydroxy- 1,2,6- trimethylpiperidine- 4- carboxylicacid
Smiles: CC1CC(O)(CC(N1C)C)C(=O)O

STK680323
Synonyms: 1- (1,3- benzodioxol- 5- yl)- N- (1,2,3,4- tetrahydroisoquinolin- 1- ylmethyl)methanamine
Smiles: N(CC1NCCc2c1cccc2)Cc1ccc2c(c1)OCO2

STK771226
Synonyms: N- [2- (3,4- diethoxyphenyl)ethyl]- 2- [1- methyl- 3- (phenylsulfanyl)- 1H- indol- 2- yl]acetamide
Smiles: CCOc1ccc(cc1OCC)CCNC(=O)Cc1c(Sc2ccccc2)c2c(n1C)cccc2

STK680326
Synonyms: 2- (1H- imidazol- 1- yl)- 1- phenylethylacetate
Smiles: CC(=O)OC(c1ccccc1)Cn1cncc1

STK680327
Synonyms: 1- phenyl- 2- (1H- pyrazol- 1- yl)ethylacetate
Smiles: CC(=O)OC(c1ccccc1)Cn1cccn1

STK771227
Synonyms: 7- ethyl- 8- [(2- hydroxyethyl)amino]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCNc1nc2c(n1CC)c(=O)n(c(=O)n2C)C

STK771228
Synonyms: 7- ethyl- 8- [(2- hydroxy- 2- phenylethyl)amino]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(NCC(c2ccccc2)O)nc2c1c(=O)n(c(=O)n2C)C

STK771232
Synonyms: (4- chloro- 3,5- diphenylfuran- 2- yl)(phenyl)methanone
Smiles: O=C(c1oc(c(c1c1ccccc1)Cl)c1ccccc1)c1ccccc1

STK771235
Synonyms: methyl3,3,3- trifluoro- 2- (2- methyl- 1H- indol- 3- yl)- 2- [(methylsulfonyl)amino]propanoate
Smiles: COC(=O)C(C(F)(F)F)(c1c(C)[nH]c2c1cccc2)NS(=O)(=O)C

STK771236
Synonyms: N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]benzenesulfonamide
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2ccccc2)nc(n1)c1ccccc1

STK771237
Synonyms: N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]- 4- methylbenzenesulfonamide
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2ccc(cc2)C)nc(n1)c1ccccc1

STK680331
Synonyms: N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]- 4- fluorobenzenesulfonamide
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2ccc(cc2)F)nc(n1)c1ccccc1

STK771238
Synonyms: N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]- 2- fluorobenzenesulfonamide
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2ccccc2F)nc(n1)c1ccccc1

STK771244
Synonyms: 2- {4- [(3- bromobenzyl)oxy]phenyl}- 5- (2,4- dichlorophenyl)- 1,3,4- oxadiazole
Smiles: Clc1ccc(c(c1)Cl)c1nnc(o1)c1ccc(cc1)OCc1cccc(c1)Br

STK771245
Synonyms: 2- {5- [(2,4- dichlorophenoxy)methyl]- 1,3,4- oxadiazol- 2- yl}phenol
Smiles: Clc1ccc(c(c1)Cl)OCc1nnc(o1)c1ccccc1O

STK771247
Synonyms: N- [(5Z)- 3- methyl- 5H- indeno[1,2- b]pyridin- 5- ylidene]aniline
Smiles: Cc1cnc2c(c1)/C(=N\c1ccccc1)/c1c2cccc1

STK771254
Synonyms: 2,2,5,5- tetramethyl- 1- [(pyridin- 4- ylcarbonyl)oxy]- 2,5- dihydro- 1H- pyrrole- 3- carboxamide
Smiles: O=C(c1ccncc1)ON1C(C)(C)C=C(C1(C)C)C(=O)N

STK680346
Synonyms: (2,2,6,6- tetramethylpiperidin- 4- yl)aceticacid
Smiles: OC(=O)CC1CC(C)(C)NC(C1)(C)C

STK680347
Synonyms: 2- (2,2,6,6- tetramethylpiperidin- 4- yl)acetamide
Smiles: NC(=O)CC1CC(C)(C)NC(C1)(C)C

STK680348
Synonyms: (2,2,6,6- tetramethyl- 1,2,3,6- tetrahydropyridin- 4- yl)aceticacid
Smiles: OC(=O)CC1=CC(NC(C1)(C)C)(C)C

STK771261
Synonyms: 3- {[4- (2,5- dimethylphenyl)piperazin- 1- yl]carbonyl}- 8- methoxy- 2H- chromen- 2- one
Smiles: COc1cccc2c1oc(=O)c(c2)C(=O)N1CCN(CC1)c1cc(C)ccc1C

STK771264
Synonyms: 5- (3- methoxyphenyl)- N- (3- methylpent- 1- yn- 3- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 3- carboxamide
Smiles: CCC(NC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1cccc(c1)OC)(C#C)C

STK771265
Synonyms: N- (3- methylpent- 1- yn- 3- yl)- 5,7- diphenylpyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: CCC(NC(=O)c1nn2c(c1)nc(cc2c1ccccc1)c1ccccc1)(C#C)C

STK771266
Synonyms: N- (3- methylpent- 1- yn- 3- yl)- 5- phenyl- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: CCC(NC(=O)c1nn2c(c1)nc(cc2C(F)(F)F)c1ccccc1)(C#C)C

STK771267
Synonyms: 5- (4- bromophenyl)- 3- chloro- N- (3- methylpent- 1- yn- 3- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: CCC(NC(=O)c1nn2c(c1Cl)nc(cc2C(F)(F)F)c1ccc(cc1)Br)(C#C)C

STK771268
Synonyms: 5- (4- methoxyphenyl)- N- (3- methylpent- 1- yn- 3- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: CCC(NC(=O)c1nn2c(c1)nc(cc2C(F)(F)F)c1ccc(cc1)OC)(C#C)C

STK771269
Synonyms: 7- (difluoromethyl)- N- (3- methylpent- 1- yn- 3- yl)- 5- phenylpyrazolo[1,5- a]pyrimidine- 3- carboxamide
Smiles: CCC(NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccccc1)(C#C)C

STK680350
Synonyms: 5- (furan- 2- yl)- N- (3- methylpent- 1- yn- 3- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 3- carboxamide
Smiles: CCC(NC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1ccco1)(C#C)C

STK771270
Synonyms: 3- chloro- 5- (furan- 2- yl)- N- (3- methylpent- 1- yn- 3- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: CCC(NC(=O)c1nn2c(c1Cl)nc(cc2C(F)(F)F)c1ccco1)(C#C)C

STK680353
Synonyms: 1- hexopyranosyl- 5- methylpyrimidine- 2,4(1H,3H)- dione
Smiles: OCC1OC(C(C(C1O)O)O)n1cc(C)c(=O)[nH]c1=O

STK771273
Synonyms: 1- (2,2- diethoxyethyl)- 5- methylpyrimidine- 2,4(1H,3H)- dione
Smiles: CCOC(Cn1cc(C)c(=O)[nH]c1=O)OCC

STK771278
Synonyms: N- [1- tert- butyl- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]- 3- cyclohexylpropanamide
Smiles: O=C(NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2C(C)(C)C)C(F)(F)F)CCC1CCCCC1

STK771279
Synonyms: N- [6,6- dimethyl- 2,4- dioxo- 1- (pyridin- 2- ylmethyl)- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl]thiophene- 2- carboxamide
Smiles: O=C1CC(C)(C)CC2=C1C(NC(=O)c1cccs1)(C(=O)N2Cc1ccccn1)C(F)(F)F

STK771283
Synonyms: N- [4- acetyl- 5- methyl- 2- oxo- 3- (trifluoromethyl)- 2,3- dihydrofuran- 3- yl]- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)NC1(C(=O)OC(=C1C(=O)C)C)C(F)(F)F

STK771289
Synonyms: ethyl2- cyano- 3- (furan- 2- yl)- 3- (2- methoxyphenyl)propanoate
Smiles: CCOC(=O)C(C(c1ccccc1OC)c1ccco1)C#N

STK680357
Synonyms: 1- [(3,4- dimethoxyphenyl)sulfonyl]- 4- (2,4- dimethylphenyl)piperazine
Smiles: COc1cc(ccc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(cc1C)C

STK680364
Synonyms: 4- fluoro- 3- methyl- N- [2- (tricyclo[3.3.1.1~3,7~]dec- 1- yloxy)ethyl]benzenesulfonamide
Smiles: Fc1ccc(cc1C)S(=O)(=O)NCCOC12CC3CC(C2)CC(C1)C3

STK771324
Synonyms: N- (2- {5- [chloro(difluoro)methoxy]- 2- methyl- 1H- indol- 3- yl}ethyl)- 4- ethoxynaphthalene- 1- sulfonamide
Smiles: CCOc1ccc(c2c1cccc2)S(=O)(=O)NCCc1c(C)[nH]c2c1cc(cc2)OC(Cl)(F)F

STK771333
Synonyms: 5- chloro- N- [2- (2,7- dimethyl- 1H- indol- 3- yl)ethyl]- 2- methoxybenzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)NCCc1c(C)[nH]c2c1cccc2C)Cl

STK771334
Synonyms: N- [2- (2,7- dimethyl- 1H- indol- 3- yl)ethyl]- 5- methoxy- 2,4- dimethylbenzenesulfonamide
Smiles: COc1cc(c(cc1C)C)S(=O)(=O)NCCc1c(C)[nH]c2c1cccc2C

STK771335
Synonyms: N- [2- (2,7- dimethyl- 1H- indol- 3- yl)ethyl]- 2- methoxy- 4,5- dimethylbenzenesulfonamide
Smiles: COc1cc(C)c(cc1S(=O)(=O)NCCc1c(C)[nH]c2c1cccc2C)C

STK771339
Synonyms: N- [2- (5- fluoro- 2- methyl- 1H- indol- 3- yl)ethyl]- 4- methoxy- 2,5- dimethylbenzenesulfonamide
Smiles: COc1cc(C)c(cc1C)S(=O)(=O)NCCc1c(C)[nH]c2c1cc(F)cc2

STK771341
Synonyms: 5- chloro- N- [2- (5- fluoro- 2- methyl- 1H- indol- 3- yl)ethyl]- 2- methoxybenzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)NCCc1c(C)[nH]c2c1cc(F)cc2)Cl

STK771346
Synonyms: N- [2- (5- fluoro- 2- methyl- 1H- indol- 3- yl)ethyl]- 4- methoxy- 3- methylbenzenesulfonamide
Smiles: COc1ccc(cc1C)S(=O)(=O)NCCc1c(C)[nH]c2c1cc(F)cc2

STK680369
Synonyms: 1- (4- methylphenyl)- 4,5- diphenyl- 1H- imidazole- 2- thiol
Smiles: Cc1ccc(cc1)n1c(S)nc(c1c1ccccc1)c1ccccc1

STK680370
Synonyms: diethyl2,4- diacetyl- 3- phenylpentanedioate
Smiles: CCOC(=O)C(C(C(C(=O)OCC)C(=O)C)c1ccccc1)C(=O)C

STK771357
Synonyms: 1- (4- methoxyphenyl)- 4- [2- nitro- 5- (pyrrolidin- 1- yl)phenyl]piperazine
Smiles: COc1ccc(cc1)N1CCN(CC1)c1cc(ccc1[N+](=O)[O-])N1CCCC1

STK771374
Synonyms: (5E)- 5- (thiophen- 2- ylmethylidene)- 1- [3- (trifluoromethyl)phenyl]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)/C(=C\c2cccs2)/C(=O)N1c1cccc(c1)C(F)(F)F

STK680389
Synonyms: 2- [(5- {[(4- methylphenyl)amino]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- 1- phenylethanone
Smiles: Cc1ccc(cc1)NCc1nnc(n1c1ccccc1)SCC(=O)c1ccccc1

STK680396
Synonyms: 6- (3,4- dichlorophenyl)- 3- methyl- 7H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine
Smiles: Clc1cc(ccc1Cl)C1=Nn2c(SC1)nnc2C

STK680398
Synonyms: N- [1,2,2- tricyano- 3- (4- methoxyphenyl)- 4,8- dimethyl- 7- oxo- 6- azabicyclo[3.2.1]oct- 5- yl]acetamide
Smiles: N#CC1(C#N)C(c2ccc(cc2)OC)C(C)C2(C(C1(C#N)C(=O)N2)C)NC(=O)C

STK771385
Synonyms: methylN- [(4- chlorophenyl)carbonyl]- 2- [(4,6- dimethylpyridin- 2- yl)amino]- 3,3,3- trifluoroalaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1)Cl)Nc1cc(C)cc(n1)C

STK771386
Synonyms: (4- methylphenyl)(2- thioxo[1,2,4]triazolo[5,1- b][1,3]benzothiazol- 1(2H)- yl)methanone
Smiles: Cc1ccc(cc1)C(=O)n1c(=S)nc2n1c1ccccc1s2

STK680421
Synonyms: [(2,2- dichlorocyclopropyl)methoxy]benzene
Smiles: ClC1(Cl)CC1COc1ccccc1

STK771408
Synonyms: 3- methyl- 1,5- dinitro- 7- phenoxy- 3- azabicyclo[3.3.1]non- 6- ene
Smiles: CN1CC2(CC(=CC(C1)(C2)[N+](=O)[O-])Oc1ccccc1)[N+](=O)[O-]

STK771411
Synonyms: methyl4- (3- amino- 5- bromo- 1- benzofuran- 2- yl)- 4- oxobutanoate
Smiles: COC(=O)CCC(=O)c1oc2c(c1N)cc(cc2)Br

STK771413
Synonyms: N- (1,1,1,3,3,3- hexafluoro- 2- {[6- (propan- 2- yl)- 1,3- benzothiazol- 2- yl]amino}propan- 2- yl)- 2- phenylacetamide
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)Nc1nc2c(s1)cc(cc2)C(C)C)Cc1ccccc1

STK771417
Synonyms: N- {1,1,1,3,3,3- hexafluoro- 2- [(6- fluoro- 1,3- benzothiazol- 2- yl)amino]propan- 2- yl}- 3- phenylpropanamide
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)Nc1nc2c(s1)cc(cc2)F)CCc1ccccc1

STK771420
Synonyms: 7- (4- chlorophenyl)- 1,3- dimethyl- 5,5- bis(trifluoromethyl)- 5,8- dihydropyrimido[4,5- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: Clc1ccc(cc1)C1=NC(c2c(N1)n(C)c(=O)n(c2=O)C)(C(F)(F)F)C(F)(F)F

STK771422
Synonyms: ethyl2- (6- amino- 1,3- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)- 3,3,3- trifluoro- 2- [(phenylcarbonyl)amino]propanoate
Smiles: CCOC(=O)C(C(F)(F)F)(c1c(N)n(C)c(=O)n(c1=O)C)NC(=O)c1ccccc1

STK680445
Synonyms: N- {1,1,1,3,3,3- hexafluoro- 2- [(5- methyl- 1,3- thiazol- 2- yl)amino]propan- 2- yl}- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1ncc(s1)C

STK771428
Synonyms: methylN- [(2,4- dichlorophenyl)carbonyl]- 3,3,3- trifluoro- 2- [(4- methyl- 1,3- thiazol- 2- yl)amino]alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1Cl)Cl)Nc1scc(n1)C

STK771430
Synonyms: N- {2- [(5- bromopyridin- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}- 2- phenylacetamide
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)Nc1ccc(cn1)Br)Cc1ccccc1

STK771434
Synonyms: ethyl2- {[2- (acetylamino)- 1,1,1- trifluoro- 3- methoxy- 3- oxopropan- 2- yl]amino}- 1,3- benzothiazole- 6- carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)sc(n2)NC(C(F)(F)F)(C(=O)OC)NC(=O)C

STK771437
Synonyms: methylN- (ethoxycarbonyl)- 3,3,3- trifluoro- 2- [(5- methylpyridin- 2- yl)amino]alaninate
Smiles: CCOC(=O)NC(C(F)(F)F)(C(=O)OC)Nc1ccc(cn1)C

STK771448
Synonyms: methyl8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocine- 3(4H)- carboxylate
Smiles: COC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

STK680476
Synonyms: methyl4- {[({5- [(4- tert- butylphenoxy)methyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)C(C)(C)C

STK680477
Synonyms: 2- ({5- [(4- tert- butylphenoxy)methyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- phenoxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)C(C)(C)C

STK680480
Synonyms: 2- ({5- [(4- tert- butylphenoxy)methyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)C(C)(C)C

STK680484
Synonyms: 2- ({5- [(4- tert- butylphenoxy)methyl]- 4- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- phenoxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1nnc(n1c1cccc(c1)C)COc1ccc(cc1)C(C)(C)C

STK680485
Synonyms: 2- ({5- [(4- tert- butylphenoxy)methyl]- 4- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- methylphenyl)acetamide
Smiles: Cc1cccc(c1)n1c(COc2ccc(cc2)C(C)(C)C)nnc1SCC(=O)Nc1cccc(c1)C

STK680533
Synonyms: (2E)- 3- {3- [(2- chlorobenzyl)oxy]phenyl}- 2- cyano- N- [2- (trifluoromethyl)phenyl]prop- 2- enamide
Smiles: N#C/C(=C\c1cccc(c1)OCc1ccccc1Cl)/C(=O)Nc1ccccc1C(F)(F)F

STK771475
Synonyms: N- (1,1,1,3,3,3- hexafluoro- 2- {[6- (propan- 2- yl)- 1,3- benzothiazol- 2- yl]amino}propan- 2- yl)- 2- methoxybenzamide
Smiles: COc1ccccc1C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1nc2c(s1)cc(cc2)C(C)C

STK771485
Synonyms: methylN- (4,6- dimethylpyridin- 2- yl)- 3,3,3- trifluoro- 2- (propanoylamino)alaninate
Smiles: CCC(=O)NC(C(F)(F)F)(C(=O)OC)Nc1cc(C)cc(n1)C

STK771495
Synonyms: methyl3,3,3- trifluoro- 2- [(4- methyl- 1,3- thiazol- 2- yl)amino]- N- (phenylcarbonyl)alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)Nc1scc(n1)C

STK771502
Synonyms: 2- {4- [(1Z)- N- hydroxyethanimidoyl]phenoxy}- N- (4- methoxyphenyl)acetamide
Smiles: O/N=C(\c1ccc(cc1)OCC(=O)Nc1ccc(cc1)OC)/C

STK771509
Synonyms: 4- formylphenyl4- methyl- 3- nitrobenzenesulfonate
Smiles: O=Cc1ccc(cc1)OS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])C

STK680591
Synonyms: 1- (4- bromophenyl)- 2- ({4- phenyl- 5- [(phenylsulfanyl)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc(n1c1ccccc1)CSc1ccccc1

STK771510
Synonyms: 4- (1H- benzotriazol- 1- yl)- 5- hydroxybenzene- 1,2- dicarbonitrile
Smiles: N#Cc1cc(c(cc1C#N)O)n1nnc2c1cccc2

STK680599
Synonyms: 2- ({5- [(4- tert- butylphenoxy)methyl]- 4- (2- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,4- dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(n1c1ccccc1C)COc1ccc(cc1)C(C)(C)C

STK680600
Synonyms: 2- ({5- [(4- tert- butylphenoxy)methyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4,6- trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)C(C)(C)C

STK680601
Synonyms: 2- ({5- [(4- tert- butylphenoxy)methyl]- 4- (2- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,6- dichlorophenyl)acetamide
Smiles: O=C(Nc1c(Cl)cccc1Cl)CSc1nnc(n1c1ccccc1C)COc1ccc(cc1)C(C)(C)C

STK680602
Synonyms: 2- ({5- [(4- tert- butylphenoxy)methyl]- 4- (2- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- phenyl- N- (propan- 2- yl)acetamide
Smiles: CC(N(c1ccccc1)C(=O)CSc1nnc(n1c1ccccc1C)COc1ccc(cc1)C(C)(C)C)C

STK680603
Synonyms: 2- ({5- [(4- tert- butylphenoxy)methyl]- 4- (2- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- phenoxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1nnc(n1c1ccccc1C)COc1ccc(cc1)C(C)(C)C

STK680605
Synonyms: 2- ({5- [(4- tert- butylphenoxy)methyl]- 4- (2- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4,6- trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1c1ccccc1C)COc1ccc(cc1)C(C)(C)C

STK680620
Synonyms: N'- (3- acetyl- 6- methyl- 4- oxo- 4H- pyran- 2- yl)- 2- phenoxyacetohydrazide
Smiles: O=C(NNc1oc(C)cc(=O)c1C(=O)C)COc1ccccc1

STK680626
Synonyms: 2- [(5- {[(3- chlorophenyl)amino]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N- (2,5- dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(n1c1ccccc1)CNc1cccc(c1)Cl

STK680628
Synonyms: 2- [(5- {[(3,4- dichlorophenyl)amino]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N- (4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1c1ccccc1)CNc1ccc(c(c1)Cl)Cl

STK771526
Synonyms: 1- acetyl- 2,3,6- triphenylpiperidin- 4- one
Smiles: O=C1CC(c2ccccc2)N(C(C1c1ccccc1)c1ccccc1)C(=O)C

STK680654
Synonyms: 4- formyl- 2- iodo- 6- methoxyphenyl4- nitrobenzenesulfonate
Smiles: O=Cc1cc(I)c(c(c1)OC)OS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

STK680655
Synonyms: 4- formylphenyl4- bromobenzoate
Smiles: O=Cc1ccc(cc1)OC(=O)c1ccc(cc1)Br

STK680656
Synonyms: 2- formylphenylnaphthalene- 2- sulfonate
Smiles: O=Cc1ccccc1OS(=O)(=O)c1ccc2c(c1)cccc2

STK771530
Synonyms: 2- ethoxy- 4- [(Z)- (2- imino- 4- oxo- 1,3- thiazolidin- 5- ylidene)methyl]phenyl4- methoxybenzenesulfonate
Smiles: CCOc1cc(ccc1OS(=O)(=O)c1ccc(cc1)OC)/C=C/1\SC(=N)NC1=O

STK771531
Synonyms: 2- chloro- 4- [(Z)- (2- imino- 4- oxo- 1,3- thiazolidin- 5- ylidene)methyl]- 6- methoxyphenyl4- (acetylamino)benzenesulfonate
Smiles: COc1cc(/C=C/2\SC(=N)NC2=O)cc(c1OS(=O)(=O)c1ccc(cc1)NC(=O)C)Cl

STK771533
Synonyms: 5- [(Z)- (2- imino- 4- oxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- methoxyphenyl4- (acetylamino)benzenesulfonate
Smiles: COc1ccc(cc1OS(=O)(=O)c1ccc(cc1)NC(=O)C)/C=C/1\SC(=N)NC1=O

STK680658
Synonyms: 2- [(Z)- (2- imino- 4- oxo- 1,3- thiazolidin- 5- ylidene)methyl]phenyl4- (acetylamino)benzenesulfonate
Smiles: N=C1S/C(=C\c2ccccc2OS(=O)(=O)c2ccc(cc2)NC(=O)C)/C(=O)N1

STK680659
Synonyms: 2- methoxy- 5- (morpholin- 4- ylcarbonothioyl)phenyl4- methoxybenzenesulfonate
Smiles: COc1ccc(cc1OS(=O)(=O)c1ccc(cc1)OC)C(=S)N1CCOCC1

STK680660
Synonyms: 2- ethoxy- 4- (morpholin- 4- ylcarbonothioyl)phenyl4- (acetylamino)benzenesulfonate
Smiles: CCOc1cc(ccc1OS(=O)(=O)c1ccc(cc1)NC(=O)C)C(=S)N1CCOCC1

STK771534
Synonyms: 2- methoxy- 4- (morpholin- 4- ylcarbonothioyl)phenyl4- (acetylamino)benzenesulfonate
Smiles: COc1cc(ccc1OS(=O)(=O)c1ccc(cc1)NC(=O)C)C(=S)N1CCOCC1

STK771535
Synonyms: 4- bromo- 2- (morpholin- 4- ylcarbonothioyl)phenyl4- (acetylamino)benzenesulfonate
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1C(=S)N1CCOCC1)Br

STK680661
Synonyms: 5- {(1E)- 2- cyano- 3- [(4- fluorophenyl)amino]- 3- oxoprop- 1- en- 1- yl}- 2- methoxyphenyl4- methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1cc(ccc1OC)/C=C(/C(=O)Nc1ccc(cc1)F)\C#N

STK680662
Synonyms: (2E)- N- [4- (acetylamino)phenyl]- 3- (3- bromo- 4,5- dimethoxyphenyl)- 2- cyanoprop- 2- enamide
Smiles: N#C/C(=C\c1cc(Br)c(c(c1)OC)OC)/C(=O)Nc1ccc(cc1)NC(=O)C

STK680663
Synonyms: (2E)- 3- {4- [(4- chlorobenzyl)oxy]- 3- methoxyphenyl}- N- [2- chloro- 5- (trifluoromethyl)phenyl]- 2- cyanoprop- 2- enamide
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OCc1ccc(cc1)Cl)/C(=O)Nc1cc(ccc1Cl)C(F)(F)F

STK771536
Synonyms: N- (2- carbamoylphenyl)- 2,3- diphenylquinoxaline- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)nc(c(n2)c1ccccc1)c1ccccc1)Nc1ccccc1C(=O)N

STK680673
Synonyms: dibenzo[b,d]furan- 2- carboxylicacid
Smiles: OC(=O)c1ccc2c(c1)c1ccccc1o2

STK771552
Synonyms: ethyl2- [({5- [(2,2- dimethylpropanoyl)amino]- 1- phenyl- 1H- pyrazol- 4- yl}carbonyl)amino]benzoate
Smiles: CCOC(=O)c1ccccc1NC(=O)c1cnn(c1NC(=O)C(C)(C)C)c1ccccc1

STK771553
Synonyms: (4- chlorophenyl)(4- ethoxyphenyl)methanone
Smiles: CCOc1ccc(cc1)C(=O)c1ccc(cc1)Cl

STK771555
Synonyms: (4- ethoxyphenyl)[5- nitro- 2- (pyrrolidin- 1- yl)phenyl]methanone
Smiles: CCOc1ccc(cc1)C(=O)c1cc(ccc1N1CCCC1)[N+](=O)[O-]

STK680691
Synonyms: 5- acetyl- 1,3- diphenyl- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: CC(=O)C1C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1

STK771559
Synonyms: 5- pentanoyl- 1,3- diphenyl- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: CCCCC(=O)C1C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1

STK680694
Synonyms: 6- tert- butyl- 3- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl]- 1,2,4- triazin- 5(4H)- one
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/Nc1nnc(c(=O)[nH]1)C(C)(C)C

STK680695
Synonyms: 6- tert- butyl- 3- [(2E)- 2- (2- nitrobenzylidene)hydrazinyl]- 1,2,4- triazin- 5(4H)- one
Smiles: [O-][N+](=O)c1ccccc1/C=N/Nc1nnc(c(=O)[nH]1)C(C)(C)C

STK680710
Synonyms: 2- [(5- {[(4- methylphenyl)sulfanyl]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1c1ccccc1)CSc1ccc(cc1)C

STK680734
Synonyms: 2- [(5- {[(3- chloro- 2- methylphenyl)amino]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1c1ccccc1)CNc1cccc(c1C)Cl

STK771608
Synonyms: methylN- acetyl- 3,3,3- trifluoro- 2- (2- phenylhydrazinyl)alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)C)NNc1ccccc1

STK680750
Synonyms: 1,5- dimethyl- 4- {[(2Z)- 3- (4- methylphenyl)- 4- phenyl- 1,3- thiazol- 2(3H)- ylidene]amino}- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Cc1ccc(cc1)n1/c(=N/c2c(=O)n(n(c2C)C)c2ccccc2)/scc1c1ccccc1

STK680768
Synonyms: 2- [(5- {[(3- chlorophenyl)amino]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1c1ccccc1)CNc1cccc(c1)Cl

STK680769
Synonyms: methyl4- ({[(5- {[(4- methylphenyl)sulfanyl]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)CSc1ccc(cc1)C

STK680770
Synonyms: 5',5'- dimethyl- 2'- (methylsulfanyl)- 4',5'- dihydro- 4H- spiro[naphthalene- 1,3'- pyrrol]- 4- one
Smiles: CSC1=NC(CC21C=CC(=O)c1c2cccc1)(C)C

STK680771
Synonyms: (2Z)- 2- (5',5'- dimethyl- 4- oxo- 2'H,4H- spiro[naphthalene- 1,3'- pyrrolidin]- 2'- ylidene)ethanamide
Smiles: NC(=O)/C=C/1\NC(CC21C=CC(=O)c1c2cccc1)(C)C

STK771614
Synonyms: 1,2,3,4- tetrahydroquinolin- 8- ol
Smiles: Oc1cccc2c1NCCC2

STK680779
Synonyms: N- (2- bromobenzyl)- N- (2,6- dimethyl- 3- {[4- (phenylcarbonyl)piperazin- 1- yl]sulfonyl}phenyl)methanesulfonamide
Smiles: Brc1ccccc1CN(S(=O)(=O)C)c1c(C)ccc(c1C)S(=O)(=O)N1CCN(CC1)C(=O)c1ccccc1

STK771617
Synonyms: 4- [(E)- {2- [(1,3- benzothiazol- 2- ylsulfanyl)acetyl]hydrazinylidene}methyl]phenyl(2,4- dioxo- 1,3- thiazolidin- 5- yl)acetate
Smiles: O=C(CSc1nc2c(s1)cccc2)N/N=C/c1ccc(cc1)OC(=O)CC1SC(=O)NC1=O

STK771620
Synonyms: 3,5a,6,11b- tetrahydro- 2H,5H- chromeno[4',3':4,5]thiopyrano[2,3- d][1,3]thiazole- 2- thione
Smiles: S=c1sc2c([nH]1)SCC1C2c2ccccc2OC1

STK771623
Synonyms: 2- chloro- 6- methoxy- 4- (morpholin- 4- ylcarbonothioyl)phenyl4- chlorobenzenesulfonate
Smiles: COc1cc(cc(c1OS(=O)(=O)c1ccc(cc1)Cl)Cl)C(=S)N1CCOCC1

STK771624
Synonyms: 4- {(E)- [2- (4- methylphenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}phenylnaphthalene- 1- carboxylate
Smiles: Cc1ccc(cc1)C1=N/C(=C/c2ccc(cc2)OC(=O)c2cccc3c2cccc3)/C(=O)O1

STK771625
Synonyms: (4E)- 4- {2- [(4- bromobenzyl)oxy]- 3- methoxybenzylidene}- 2- (4- methylphenyl)- 1,3- oxazol- 5(4H)- one
Smiles: COc1cccc(c1OCc1ccc(cc1)Br)/C=C\1/N=C(OC1=O)c1ccc(cc1)C

STK771626
Synonyms: 2- methoxy- 4- {(E)- [2- (4- methylphenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}phenylbenzenesulfonate
Smiles: COc1cc(ccc1OS(=O)(=O)c1ccccc1)/C=C\1/N=C(OC1=O)c1ccc(cc1)C

STK771630
Synonyms: 4- {(E)- [2- (4- methylphenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}phenyl4- methoxybenzenesulfonate
Smiles: COc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)/C=C\1/N=C(OC1=O)c1ccc(cc1)C

STK771631
Synonyms: 4- bromo- 2- {(E)- [2- (4- methylphenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}phenylbenzenesulfonate
Smiles: Brc1ccc(c(c1)/C=C\1/N=C(OC1=O)c1ccc(cc1)C)OS(=O)(=O)c1ccccc1

STK771632
Synonyms: (4E)- 4- {3- chloro- 4- [(2- chlorobenzyl)oxy]benzylidene}- 2- (4- methylphenyl)- 1,3- oxazol- 5(4H)- one
Smiles: Cc1ccc(cc1)C1=N/C(=C/c2ccc(c(c2)Cl)OCc2ccccc2Cl)/C(=O)O1

STK771633
Synonyms: 2- {(E)- [2- (4- methylphenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}phenylnaphthalene- 1- carboxylate
Smiles: Cc1ccc(cc1)C1=N/C(=C/c2ccccc2OC(=O)c2cccc3c2cccc3)/C(=O)O1

STK771634
Synonyms: (4E)- 4- [4- (benzyloxy)- 3- bromobenzylidene]- 2- (4- methylphenyl)- 1,3- oxazol- 5(4H)- one
Smiles: Cc1ccc(cc1)C1=N/C(=C/c2ccc(c(c2)Br)OCc2ccccc2)/C(=O)O1

STK771635
Synonyms: (4E)- 4- {2- [(2,4- dichlorobenzyl)oxy]- 3- methoxybenzylidene}- 2- (4- methylphenyl)- 1,3- oxazol- 5(4H)- one
Smiles: COc1cccc(c1OCc1ccc(cc1Cl)Cl)/C=C\1/N=C(OC1=O)c1ccc(cc1)C

STK771636
Synonyms: 2- ethoxy- 4- (morpholin- 4- ylcarbonothioyl)phenylnaphthalene- 1- carboxylate
Smiles: CCOc1cc(ccc1OC(=O)c1cccc2c1cccc2)C(=S)N1CCOCC1

STK771639
Synonyms: ethyl4- (5- {(E)- [2- (4- methylphenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}furan- 2- yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C\1/N=C(OC1=O)c1ccc(cc1)C

STK771640
Synonyms: 3- {(E)- [2- (4- methylphenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}phenyl3- fluorobenzoate
Smiles: Cc1ccc(cc1)C1=N/C(=C/c2cccc(c2)OC(=O)c2cccc(c2)F)/C(=O)O1

STK771642
Synonyms: (4E)- 4- {[5- (4- methoxy- 2- nitrophenyl)furan- 2- yl]methylidene}- 2- (4- methylphenyl)- 1,3- oxazol- 5(4H)- one
Smiles: COc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=C\1/N=C(OC1=O)c1ccc(cc1)C

STK771643
Synonyms: (4E)- 4- {4- [(3,4- dichlorobenzyl)oxy]- 3- methoxybenzylidene}- 2- (4- methylphenyl)- 1,3- oxazol- 5(4H)- one
Smiles: COc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)/C=C\1/N=C(OC1=O)c1ccc(cc1)C

STK771645
Synonyms: N- (2,4- dimethylphenyl)- 2,3- diphenylquinoxaline- 6- carboxamide
Smiles: Cc1ccc(c(c1)C)NC(=O)c1ccc2c(c1)nc(c(n2)c1ccccc1)c1ccccc1

STK771646
Synonyms: 2- ethoxy- 4- (morpholin- 4- ylcarbonothioyl)phenyl4- methoxybenzenesulfonate
Smiles: CCOc1cc(ccc1OS(=O)(=O)c1ccc(cc1)OC)C(=S)N1CCOCC1

STK680789
Synonyms: 2- {(E)- [2- (4- chlorophenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}phenyl4- (acetylamino)benzenesulfonate
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Oc1ccccc1/C=C\1/N=C(OC1=O)c1ccc(cc1)Cl

STK680790
Synonyms: 2- chloro- 4- (morpholin- 4- ylcarbonothioyl)phenylbenzenesulfonate
Smiles: Clc1cc(ccc1OS(=O)(=O)c1ccccc1)C(=S)N1CCOCC1

STK680794
Synonyms: 4- methyl- N- [(2Z)- 3- (3- methylphenyl)- 4- phenyl- 1,3- thiazol- 2(3H)- ylidene]aniline
Smiles: Cc1cccc(c1)n1/c(=N/c2ccc(cc2)C)/scc1c1ccccc1

STK680800
Synonyms: 3- amino- 4- (morpholin- 4- yl)- 5,6,7,7a- tetrahydro- 1H- indene- 1,1,2- tricarbonitrile
Smiles: N#CC1=C(N)C2=C(CCCC2C1(C#N)C#N)N1CCOCC1

STK680801
Synonyms: [2- oxo- 2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethyl]propanedinitrile
Smiles: N#CC(CC(=O)C12CC3CC(C2)CC(C1)C3)C#N

STK680820
Synonyms: 2',2',6',6',10b- pentamethyl- 6,10b- dihydro- 5H- spiro[1,3- oxazolo[4,3- a]isoquinoline- 1,4'- piperidin]- 3- one
Smiles: O=C1OC2(C3(N1CCc1c3cccc1)C)CC(C)(C)NC(C2)(C)C

STK771670
Synonyms: 4- hydroxy- 3- [2- (5- methoxy- 2- methyl- 1H- indol- 3- yl)ethyl]- 4,5,5- trimethyl- 1,3- oxazolidin- 2- one
Smiles: COc1ccc2c(c1)c(CCN1C(=O)OC(C1(C)O)(C)C)c([nH]2)C

STK771673
Synonyms: 3- (1,3- dioxo- 1,3- dihydro- 2H- pyrrolo[3,4- c]pyridin- 2- yl)propanoicacid
Smiles: OC(=O)CCN1C(=O)c2c(C1=O)cncc2

STK680822
Synonyms: 4- (2,3,4- trimethoxyphenyl)- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: COc1c(OC)ccc(c1OC)C1NCc2c(n3c1ccc3)cccc2

STK680830
Synonyms: 3- (2- hydroxyphenyl)- 5- (naphthalen- 1- yl)- 4,6- dioxo- 1- propyloctahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: CCCC1(NC(C2C1C(=O)N(C2=O)c1cccc2c1cccc2)c1ccccc1O)C(=O)O

STK680834
Synonyms: 5'- (naphthalen- 1- yl)- 3'- propyldihydro- 2H,2'H- spiro[pyrimidine- 5,1'- pyrrolo[3,4- c]pyrrole]- 2,4,4',6,6'(1H,3H,3'H,5'H)- pentone
Smiles: CCCC1NC2(C3C1C(=O)N(C3=O)c1cccc3c1cccc3)C(=O)NC(=O)NC2=O

STK771675
Synonyms: 4- (ethoxycarbonyl)benzyl4- amino- 1,2,5- oxadiazole- 3- carboxylate
Smiles: CCOC(=O)c1ccc(cc1)COC(=O)c1nonc1N

STK680837
Synonyms: 1- {2- [5- (benzyloxy)- 2- methyl- 1H- indol- 3- yl]ethyl}- 3- cyclohexylurea
Smiles: O=C(NC1CCCCC1)NCCc1c(C)[nH]c2c1cc(OCc1ccccc1)cc2

STK680838
Synonyms: 2- fluoro- N- {[4- phenyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}benzenesulfonamide
Smiles: O=C(NS(=O)(=O)c1ccccc1F)Nc1nc(cc(n1)C(F)(F)F)c1ccccc1

STK680839
Synonyms: 4- fluoro- N- {[4- phenyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}benzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)NC(=O)Nc1nc(cc(n1)C(F)(F)F)c1ccccc1

STK680841
Synonyms: (3- methylfuran- 2- yl)(piperazin- 1- yl)methanone
Smiles: Cc1ccoc1C(=O)N1CCNCC1

STK680842
Synonyms: N- (2- aminoethyl)- 3- methylfuran- 2- carboxamide
Smiles: NCCNC(=O)c1occc1C

STK680843
Synonyms: N- (3- aminopropyl)- 3- methylfuran- 2- carboxamide
Smiles: NCCCNC(=O)c1occc1C

STK680844
Synonyms: N- (3- aminopropyl)- 5- tert- butyl- 3- methylfuran- 2- carboxamide
Smiles: NCCCNC(=O)c1oc(cc1C)C(C)(C)C

STK771681
Synonyms: 9- [2,3- O- (1- methylethylidene)pentofuranosyl]- 9H- purin- 6- ol
Smiles: OCC1OC(C2C1OC(O2)(C)C)n1cnc2c1ncnc2O

STK771682
Synonyms: N'- [(1Z)- 1- cyano- 1- phenylprop- 1- en- 2- yl]- 3,5- dimethoxybenzohydrazide
Smiles: COc1cc(OC)cc(c1)C(=O)NN/C(=C(/c1ccccc1)\C#N)/C

STK771687
Synonyms: ethyl4- [(4- cyclohexylphenyl)sulfonyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C1CCCCC1

STK771690
Synonyms: N- [2- (2,7- dimethyl- 1H- indol- 3- yl)ethyl]- 6- methoxy- 2- oxo- 2H- chromene- 3- carboxamide
Smiles: COc1ccc2c(c1)cc(c(=O)o2)C(=O)NCCc1c(C)[nH]c2c1cccc2C

STK680849
Synonyms: N- (9H- fluoren- 9- yl)furan- 2- carboxamide
Smiles: O=C(c1ccco1)NC1c2ccccc2c2c1cccc2

STK680851
Synonyms: [4- ({[2- oxo- 8- (prop- 2- en- 1- yl)- 2H- chromen- 3- yl]carbonyl}amino)phenyl]aceticacid
Smiles: C=CCc1cccc2c1oc(=O)c(c2)C(=O)Nc1ccc(cc1)CC(=O)O

STK680853
Synonyms: 3- (3,4- dimethoxyphenyl)- 3- {[(2- oxo- 2H- chromen- 3- yl)carbonyl]amino}propanoicacid
Smiles: COc1cc(ccc1OC)C(NC(=O)c1cc2ccccc2oc1=O)CC(=O)O

STK771704
Synonyms: 6- nitro- 2- oxo- N- (tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl)- 2H- chromene- 3- carboxamide
Smiles: O=C(c1cc2cc(ccc2oc1=O)[N+](=O)[O-])NCC12CC3CC(C2)CC(C1)C3

STK771712
Synonyms: N- [2- (5- fluoro- 2- methyl- 1H- indol- 3- yl)ethyl]- 3- nitrobenzamide
Smiles: Fc1ccc2c(c1)c(CCNC(=O)c1cccc(c1)[N+](=O)[O-])c([nH]2)C

STK771715
Synonyms: N- [2- (2,7- dimethyl- 1H- indol- 3- yl)ethyl]- 3,4- dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)NCCc1c(C)[nH]c2c1cccc2C

STK771722
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 4- (trifluoromethyl)benzamide
Smiles: O=C(c1ccc(cc1)C(F)(F)F)Nc1ccc2c(c1)OCCO2

STK771725
Synonyms: 2- {[(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CO/N=C/1\CCCc2c1non2

STK771730
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- [5- (2- fluorophenyl)- 2H- tetrazol- 2- yl]acetamide
Smiles: COc1cc(CCNC(=O)Cn2nnc(n2)c2ccccc2F)ccc1OC

STK771734
Synonyms: (1S,2S,5R)- 2- [5- (2- chlorophenyl)- 1H- tetrazol- 1- yl]- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nnnc1c1ccccc1Cl

STK771739
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- {[1- (2- methoxyphenyl)- 1H- tetrazol- 5- yl]sulfanyl}acetamide
Smiles: COc1cc(CCNC(=O)CSc2nnnn2c2ccccc2OC)ccc1OC

STK771743
Synonyms: N- benzyl- 2- ({5- [4- (trifluoromethoxy)phenyl]- 1H- tetrazol- 1- yl}sulfanyl)acetamide
Smiles: O=C(CSn1nnnc1c1ccc(cc1)OC(F)(F)F)NCc1ccccc1

STK771744
Synonyms: 2- [2- (4- amino- 1,2,5- oxadiazol- 3- yl)- 1H- benzimidazol- 1- yl]- N'- [(E)- {5- [4- (trifluoromethoxy)phenyl]furan- 2- yl}methylidene]acetohydrazide
Smiles: O=C(Cn1c(nc2c1cccc2)c1nonc1N)N/N=C/c1ccc(o1)c1ccc(cc1)OC(F)(F)F

STK680860
Synonyms: 2- [(1- benzyl- 1H- 1,2,3- triazol- 4- yl)methyl]- 5- phenyl- 2H- tetrazole
Smiles: c1ccc(cc1)Cn1nnc(c1)Cn1nnc(n1)c1ccccc1

STK771746
Synonyms: 2- {[(2,4- dimethyl- 3H- 1,5- benzodiazepin- 3- ylidene)amino]oxy}- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CO/N=c/1\c(C)nc2c(nc1C)cccc2

STK771750
Synonyms: 2- {[5- (2- fluorophenyl)- 2H- tetrazol- 2- yl]methyl}pyridine
Smiles: Fc1ccccc1c1nnn(n1)Cc1ccccn1

STK680862
Synonyms: 3- ({[4- (trifluoromethyl)phenyl]carbonyl}amino)- 1- benzofuran- 2- carboxylicacid
Smiles: O=C(c1ccc(cc1)C(F)(F)F)Nc1c(oc2c1cccc2)C(=O)O

STK680864
Synonyms: 4- [4,4- dimethyl- 2- (methylamino)- 6- oxocyclohex- 1- en- 1- yl]- N- methyl- 4- oxobutanamide
Smiles: CNC(=O)CCC(=O)C1=C(NC)CC(CC1=O)(C)C

STK680865
Synonyms: N- (2- acetyl- 1- benzofuran- 3- yl)- 4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)butanamide
Smiles: O=C(Nc1c(oc2c1cccc2)C(=O)C)CCCN1C(=O)c2c(C1=O)cccc2

STK771752
Synonyms: N- [2- (cyclopropylcarbonyl)- 1- benzofuran- 3- yl]- 4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)butanamide
Smiles: O=C(Nc1c(oc2c1cccc2)C(=O)C1CC1)CCCN1C(=O)c2c(C1=O)cccc2

STK771753
Synonyms: N- [2- (cyclopropylcarbonyl)- 5- methoxy- 1- benzofuran- 3- yl]- 4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)butanamide
Smiles: COc1ccc2c(c1)c(NC(=O)CCCN1C(=O)c3c(C1=O)cccc3)c(o2)C(=O)C1CC1

STK771755
Synonyms: ethyl3- [chloro(difluoro)methyl]- 3- hydroxy- 5,6- dimethyl- 2- oxo- 3,5- dihydro- 2H- furo[2,3- f]indole- 7- carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc1OC(=O)C(c1c2)(O)C(Cl)(F)F)C

STK680866
Synonyms: [5- hydroxy- 4- (piperidin- 1- ylmethyl)- 1- benzofuran- 3- yl](4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)c1coc2c1c(CN1CCCCC1)c(cc2)O

STK680868
Synonyms: [5- hydroxy- 4- (pyrrolidin- 1- ylmethyl)- 1- benzofuran- 3- yl](4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)c1coc2c1c(CN1CCCC1)c(cc2)O

STK771758
Synonyms: cyclopropyl[3- (1H- pyrrol- 1- yl)- 1- benzofuran- 2- yl]methanone
Smiles: O=C(c1oc2c(c1n1cccc1)cccc2)C1CC1

STK680872
Synonyms: 5- benzyl- 1- ethyl- 3- (2- hydroxyphenyl)- 4,6- dioxooctahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: CCC1(NC(C2C1C(=O)N(C2=O)Cc1ccccc1)c1ccccc1O)C(=O)O

STK771760
Synonyms: 5- methyl- 7- (morpholin- 4- yl)- 3- phenyl[1,3]thiazolo[4,5- d]pyrimidine- 2(3H)- thione
Smiles: Cc1nc(N2CCOCC2)c2c(n1)n(c1ccccc1)c(=S)s2

STK771763
Synonyms: ethyl[6,6- dimethyl- 2,4- dioxo- 1- (2- phenylethyl)- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl]carbamate
Smiles: CCOC(=O)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)CCc1ccccc1)C(F)(F)F

STK771764
Synonyms: ethyl[6,6- dimethyl- 2,4- dioxo- 1- (pyridin- 2- ylmethyl)- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl]carbamate
Smiles: CCOC(=O)NC1(C2=C(N(C1=O)Cc1ccccn1)CC(CC2=O)(C)C)C(F)(F)F

STK771772
Synonyms: N- [4- cyano- 5- methyl- 2- oxo- 3- (trifluoromethyl)- 2,3- dihydro- 1H- pyrrol- 3- yl]furan- 2- carboxamide
Smiles: N#CC1=C(C)NC(=O)C1(NC(=O)c1ccco1)C(F)(F)F

STK771774
Synonyms: N- [1,3- dimethyl- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]furan- 2- carboxamide
Smiles: O=C(c1ccco1)NC1(C(=O)Nc2c1c(=O)n(c(=O)n2C)C)C(F)(F)F

STK771775
Synonyms: N- [1- methyl- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]furan- 2- carboxamide
Smiles: O=C1Nc2c(C1(NC(=O)c1ccco1)C(F)(F)F)c(=O)[nH]c(=O)n2C

STK771776
Synonyms: N- [1- benzyl- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]furan- 2- carboxamide
Smiles: O=C1Nc2c(C1(NC(=O)c1ccco1)C(F)(F)F)c(=O)[nH]c(=O)n2Cc1ccccc1

STK771780
Synonyms: N- {1- [2- (3,4- dimethoxyphenyl)ethyl]- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl}thiophene- 2- carboxamide
Smiles: COc1cc(ccc1OC)CCn1c(=O)[nH]c(=O)c2c1NC(=O)C2(NC(=O)c1cccs1)C(F)(F)F

STK680877
Synonyms: N- [1- (2- methylpropyl)- 2,5- dioxo- 4- (trifluoromethyl)imidazolidin- 4- yl]thiophene- 2- carboxamide
Smiles: CC(CN1C(=O)NC(C1=O)(NC(=O)c1cccs1)C(F)(F)F)C

STK771787
Synonyms: 6,6- dimethyl- 3- (5- methyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 1- (4- methylphenyl)- 3- (trifluoromethyl)- 3,5,6,7- tetrahydro- 1H- indole- 2,4- dione
Smiles: Cc1ccc(cc1)N1C2=C(C(C1=O)(c1c(C)[nH]n(c1=O)c1ccccc1)C(F)(F)F)C(=O)CC(C2)(C)C

STK771788
Synonyms: N- [4- cyano- 5- methyl- 2- oxo- 3- (trifluoromethyl)- 2,3- dihydro- 1H- pyrrol- 3- yl]- 4- methoxybenzamide
Smiles: N#CC1=C(C)NC(=O)C1(NC(=O)c1ccc(cc1)OC)C(F)(F)F

STK680878
Synonyms: 3- cyclohexyl- N- [1- methyl- 2,5- dioxo- 4- (trifluoromethyl)imidazolidin- 4- yl]propanamide
Smiles: CN1C(=O)NC(C1=O)(NC(=O)CCC1CCCCC1)C(F)(F)F

STK771792
Synonyms: 3- cyclohexyl- N- [2,5- dioxo- 1- (2- phenylethyl)- 4- (trifluoromethyl)imidazolidin- 4- yl]propanamide
Smiles: O=C(NC1(NC(=O)N(C1=O)CCc1ccccc1)C(F)(F)F)CCC1CCCCC1

STK680880
Synonyms: 8- methyl- 2- (thiophen- 2- yl)indolizine
Smiles: Cc1cccn2c1cc(c2)c1cccs1

STK771801
Synonyms: N- [1- (3- chloro- 4- fluorophenyl)- 2,5- dioxo- 4- (trifluoromethyl)imidazolidin- 4- yl]benzamide
Smiles: O=C1NC(C(=O)N1c1ccc(c(c1)Cl)F)(NC(=O)c1ccccc1)C(F)(F)F

STK771803
Synonyms: 3- methoxy- N- [5- oxo- 6- (trifluoromethyl)- 2,3,5,6- tetrahydroimidazo[2,1- b][1,3]thiazol- 6- yl]benzamide
Smiles: COc1cccc(c1)C(=O)NC1(N=C2N(C1=O)CCS2)C(F)(F)F

STK771804
Synonyms: N- {1- [2- (3,4- dimethoxyphenyl)ethyl]- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl}benzamide
Smiles: COc1cc(ccc1OC)CCn1c(=O)[nH]c(=O)c2c1NC(=O)C2(NC(=O)c1ccccc1)C(F)(F)F

STK771806
Synonyms: N- [1- (3- chlorophenyl)- 2,5- dioxo- 4- (trifluoromethyl)imidazolidin- 4- yl]benzamide
Smiles: Clc1cccc(c1)N1C(=O)NC(C1=O)(NC(=O)c1ccccc1)C(F)(F)F

STK771807
Synonyms: 5- phenyl- 3- (pyridin- 3- ylmethyl)- 5- (trifluoromethyl)imidazolidine- 2,4- dione
Smiles: O=C1NC(C(=O)N1Cc1cccnc1)(c1ccccc1)C(F)(F)F

STK771813
Synonyms: 2- chlorophenyl[(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]sulfamate
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)Oc2ccccc2Cl)nc(n1)c1ccccc1

STK771814
Synonyms: 3,4- dichlorophenyl[(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]sulfamate
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)Oc2ccc(c(c2)Cl)Cl)nc(n1)c1ccccc1

STK771815
Synonyms: 2,5- dichlorophenyl[(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]sulfamate
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)Oc2cc(Cl)ccc2Cl)nc(n1)c1ccccc1

STK771822
Synonyms: 2- chlorophenyl{[4- phenyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}sulfamate
Smiles: O=C(NS(=O)(=O)Oc1ccccc1Cl)Nc1nc(cc(n1)C(F)(F)F)c1ccccc1

STK771823
Synonyms: 2,4- difluorophenyl{[4- phenyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}sulfamate
Smiles: Fc1ccc(c(c1)F)OS(=O)(=O)NC(=O)Nc1nc(cc(n1)C(F)(F)F)c1ccccc1

STK680885
Synonyms: methyl2- cyclohexyl- 6- (dimethylamino)- 4- (trifluoromethyl)- 4H- 1,3,5- oxadiazine- 4- carboxylate
Smiles: COC(=O)C1(N=C(OC(=N1)N(C)C)C1CCCCC1)C(F)(F)F

STK771826
Synonyms: N- [1- methyl- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]benzamide
Smiles: O=C1Nc2c(C1(NC(=O)c1ccccc1)C(F)(F)F)c(=O)[nH]c(=O)n2C

STK680886
Synonyms: N,N'- {benzene- 1,4- diylbis[2,5- dioxo- 4- (trifluoromethyl)imidazolidine- 1,4- diyl]}dipentanamide
Smiles: CCCCC(=O)NC1(NC(=O)N(C1=O)c1ccc(cc1)N1C(=O)NC(C1=O)(NC(=O)CCCC)C(F)(F)F)C(F)(F)F

STK680887
Synonyms: 7- nitro- 5- ({4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}methyl)quinolin- 8- ol
Smiles: [O-][N+](=O)c1cc(CN2CCN(CC2)c2cccc(c2)C(F)(F)F)c2c(c1O)nccc2

STK771833
Synonyms: 2,4- dichlorophenyl[(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]sulfamate
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)Oc2ccc(cc2Cl)Cl)nc(n1)c1ccccc1

STK680888
Synonyms: 5,5- dimethyl- 2,3- dioxo- 2,3,5,6- tetrahydropyrrolo[2,1- a]isoquinoline- 1- carbonitrile
Smiles: N#CC1=C2c3ccccc3CC(N2C(=O)C1=O)(C)C

STK771836
Synonyms: [1- (4- bromophenyl)- 1H- 1,2,3- triazole- 4,5- diyl]dimethanol
Smiles: OCc1c(CO)nnn1c1ccc(cc1)Br

STK680893
Synonyms: 3- (4- ethoxyphenyl)- 3- [(phenylacetyl)amino]propanoicacid
Smiles: CCOc1ccc(cc1)C(NC(=O)Cc1ccccc1)CC(=O)O

STK771839
Synonyms: 1- [(3- methoxypropyl)amino]- 3H- naphtho[1,2,3- de]quinoline- 2,7- dione
Smiles: COCCCNc1c(=O)[nH]c2c3c1c1ccccc1c(=O)c3ccc2

STK680895
Synonyms: 3- (4- ethoxyphenyl)- 3- {[(4- fluorophenyl)acetyl]amino}propanoicacid
Smiles: CCOc1ccc(cc1)C(CC(=O)O)NC(=O)Cc1ccc(cc1)F

STK680898
Synonyms: 3- {[4- (4- chloro- 2- methylphenoxy)butanoyl]amino}- 3- (4- ethoxyphenyl)propanoicacid
Smiles: CCOc1ccc(cc1)C(CC(=O)O)NC(=O)CCCOc1ccc(cc1C)Cl

STK771841
Synonyms: 2- (2- fluorophenyl)- 5,7- dimethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- ol
Smiles: OC1C2(C)CN3CC1(C)CN(C2)C3c1ccccc1F

STK771845
Synonyms: 3,7- bis[(4- methoxyphenyl)carbonyl]- 1,5- dimethyl- 3,7- diazabicyclo[3.3.1]nonan- 9- one
Smiles: COc1ccc(cc1)C(=O)N1CC2(C)CN(CC(C1)(C2=O)C)C(=O)c1ccc(cc1)OC

STK771847
Synonyms: 3- (2- methyl- 1H- indol- 3- yl)pyrrolidine- 2,5- dione
Smiles: O=C1NC(=O)C(C1)c1c(C)[nH]c2c1cccc2

STK771849
Synonyms: 4- (3,4- dimethoxyphenyl)- N- (3,4- dimethylphenyl)tetrahydro- 2H- pyran- 4- carboxamide
Smiles: COc1cc(ccc1OC)C1(CCOCC1)C(=O)Nc1ccc(c(c1)C)C

STK680900
Synonyms: 4- ({2- [2- ethyl- 2- methyl- 4- (4- methylphenyl)tetrahydro- 2H- pyran- 4- yl]ethyl}amino)- 4- oxobutanoicacid
Smiles: CCC1(C)OCCC(C1)(CCNC(=O)CCC(=O)O)c1ccc(cc1)C

STK771854
Synonyms: 1- (1- phenyl- 1H- tetrazol- 5- yl)- 1H- benzimidazole
Smiles: c1ccc(cc1)n1nnnc1n1cnc2c1cccc2

STK680902
Synonyms: (1E)- N- (4- hydroxy- 2- methylphenyl)- N'- [(4- methylphenyl)sulfonyl]ethanimidamide
Smiles: Cc1ccc(cc1)S(=O)(=O)/N=C(/Nc1ccc(cc1C)O)\C

STK680903
Synonyms: (1E)- N'- [(4- chlorophenyl)sulfonyl]- N- (4- hydroxy- 2- methylphenyl)ethanimidamide
Smiles: Clc1ccc(cc1)S(=O)(=O)/N=C(/Nc1ccc(cc1C)O)\C

STK771859
Synonyms: N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]- 4- methoxybenzenesulfonamide
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2ccc(cc2)OC)nc(n1)c1ccccc1

STK680904
Synonyms: 3,4- dichloro- N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]benzenesulfonamide
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2ccc(c(c2)Cl)Cl)nc(n1)c1ccccc1

STK771860
Synonyms: N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]- 4- (trifluoromethoxy)benzenesulfonamide
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2ccc(cc2)OC(F)(F)F)nc(n1)c1ccccc1

STK680905
Synonyms: 5- fluoro- 1- [(2- hydroxyethoxy)methyl]pyrimidine- 2,4(1H,3H)- dione
Smiles: OCCOCn1cc(F)c(=O)[nH]c1=O

STK680907
Synonyms: N- {[4- (thiophen- 2- yl)- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}- 4- (trifluoromethoxy)benzenesulfonamide
Smiles: O=C(NS(=O)(=O)c1ccc(cc1)OC(F)(F)F)Nc1nc(cc(n1)C(F)(F)F)c1cccs1

STK680908
Synonyms: N- {[4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]carbamoyl}- 4- (trifluoromethoxy)benzenesulfonamide
Smiles: O=C(NS(=O)(=O)c1ccc(cc1)OC(F)(F)F)Nc1scc(n1)c1ccc(cc1)F

STK680909
Synonyms: N- {[4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]carbamoyl}- 4- (trifluoromethoxy)benzenesulfonamide
Smiles: O=C(NS(=O)(=O)c1ccc(cc1)OC(F)(F)F)Nc1scc(n1)c1ccc(cc1Cl)Cl

STK771862
Synonyms: 4- hydroxy- 1- pentofuranosylpyrimidine- 2(1H)- thione
Smiles: OCC1OC(C(C1O)O)n1ccc(nc1=S)O

STK771863
Synonyms: 5,7- dimethylpyrazolo[1,5- a]pyrimidin- 2(1H)- one
Smiles: Cc1cc(C)nc2n1[nH]c(=O)c2

STK680911
Synonyms: 3- hydroxy- 4- methyl- 2- phenyl- 2,7- dihydro- 6H- pyrazolo[3,4- b]pyridin- 6- one
Smiles: O=c1cc(C)c2c([nH]1)nn(c2O)c1ccccc1

STK680913
Synonyms: 3- hydroxy- 4,5- dimethyl- 2- phenyl- 2,7- dihydro- 6H- pyrazolo[3,4- b]pyridin- 6- one
Smiles: O=c1[nH]c2nn(c(c2c(c1C)C)O)c1ccccc1

STK680915
Synonyms: 4,6- bis(trifluoromethyl)- 2H- pyrazolo[3,4- b]pyridin- 3- ol
Smiles: Oc1[nH]nc2c1c(cc(n2)C(F)(F)F)C(F)(F)F

STK680916
Synonyms: 3- methylphenyl[(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]sulfamate
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)Oc2cccc(c2)C)nc(n1)c1ccccc1

STK771866
Synonyms: ethyl3- oxo- 5- phenyl- 1- (piperidin- 1- yl)- 3H- pyrrolizine- 2- carboxylate
Smiles: CCOC(=O)C1=C(N2CCCCC2)c2n(C1=O)c(cc2)c1ccccc1

STK771867
Synonyms: methyl2- ({[4- (thiophen- 2- yl)- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}sulfamoyl)benzoate
Smiles: COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1nc(cc(n1)C(F)(F)F)c1cccs1

STK771872
Synonyms: 3- (4- hydroxyphenyl)- 5,6- dimethyl- 2- phenyl- 2,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: CC1Cc2nn(c(c2C(=O)C1C)c1ccc(cc1)O)c1ccccc1

STK680924
Synonyms: 3- (4- hydroxyphenyl)- 2- phenyl- 2,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: Oc1ccc(cc1)c1c2C(=O)CCCc2nn1c1ccccc1

STK680925
Synonyms: 2- phenyl- 3- (thiophen- 2- yl)- 2,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: O=C1CCCc2c1c(c1cccs1)n(n2)c1ccccc1

STK771874
Synonyms: 6,6- dimethyl- 3- (thiophen- 2- yl)- 1,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: O=C1CC(C)(C)Cc2c1c(n[nH]2)c1cccs1

STK680926
Synonyms: 6,6- dimethyl- 3- (pyridin- 3- yl)- 1,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: O=C1CC(C)(C)Cc2c1c(n[nH]2)c1cccnc1

STK680927
Synonyms: 3- (4- hydroxyphenyl)- 1,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: Oc1ccc(cc1)c1n[nH]c2c1C(=O)CCC2

STK680928
Synonyms: 9- methyl- 2- (morpholin- 4- yl)- 7- (pyridin- 2- yl)- 6,7- dihydro- 5H- pyrazolo[3,4- h]quinazoline
Smiles: Cc1nn(c2c1c1nc(ncc1CC2)N1CCOCC1)c1ccccn1

STK680929
Synonyms: 9- methyl- 7- (pyridin- 2- yl)- 6,7- dihydro- 5H- pyrazolo[3,4- h]quinazolin- 2- amine
Smiles: Nc1ncc2c(n1)c1c(C)nn(c1CC2)c1ccccn1

STK680931
Synonyms: 3- [4- (dimethylamino)phenyl]- 1,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: O=C1CCCc2c1c(n[nH]2)c1ccc(cc1)N(C)C

STK771877
Synonyms: N,N'- bis(2- methylphenyl)pyridazine- 3,6- diamine
Smiles: Cc1ccccc1Nc1ccc(nn1)Nc1ccccc1C

STK771883
Synonyms: 2- (furan- 2- yl)- 3- (methylsulfonyl)- 1,3- thiazolidine
Smiles: CS(=O)(=O)N1CCSC1c1ccco1

STK680932
Synonyms: 3- benzyl- 4- oxo- 4- {[4- (trifluoromethoxy)phenyl]amino}butanoicacid
Smiles: OC(=O)CC(C(=O)Nc1ccc(cc1)OC(F)(F)F)Cc1ccccc1

STK680934
Synonyms: 4- methyl- 6- {[4- (trifluoromethoxy)phenyl]carbamoyl}cyclohex- 3- ene- 1- carboxylicacid
Smiles: O=C(C1CC(=CCC1C(=O)O)C)Nc1ccc(cc1)OC(F)(F)F

STK680935
Synonyms: 3- (3- methylbenzyl)- 4- oxo- 4- {[4- (trifluoromethoxy)phenyl]amino}butanoicacid
Smiles: OC(=O)CC(C(=O)Nc1ccc(cc1)OC(F)(F)F)Cc1cccc(c1)C

STK771890
Synonyms: 1- (7'- methoxy- 2'- phenyl- 1',10b'- dihydro- 1H- spiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazin]- 1- yl)ethanone
Smiles: COc1cccc2c1OC1(CCN(CC1)C(=O)C)N1C2CC(=N1)c1ccccc1

STK680937
Synonyms: 3- {[(3- methylphenyl)carbonyl]amino}- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NC(=O)c1cccc(c1)C

STK680938
Synonyms: 3- [(phenylacetyl)amino]- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NC(=O)Cc1ccccc1

STK680940
Synonyms: 3- {[(4- chlorophenyl)sulfonyl]amino}- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NS(=O)(=O)c1ccc(cc1)Cl

STK680945
Synonyms: 3- {[(4- chlorophenyl)sulfonyl]amino}- 3- (4- ethoxyphenyl)propanoicacid
Smiles: CCOc1ccc(cc1)C(NS(=O)(=O)c1ccc(cc1)Cl)CC(=O)O

STK771892
Synonyms: methyl3,3,3- trifluoro- 2- (5- methyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 2- [(trifluoroacetyl)amino]propanoate
Smiles: COC(=O)C(C(F)(F)F)(c1c(C)[nH]n(c1=O)c1ccccc1)NC(=O)C(F)(F)F

STK771893
Synonyms: 1- benzyl2- methyl4,5- dimethyl- 2- (trifluoromethyl)- 3,6- dihydropyridine- 1,2(2H)- dicarboxylate
Smiles: COC(=O)C1(CC(=C(CN1C(=O)OCc1ccccc1)C)C)C(F)(F)F

STK680948
Synonyms: methyl2- {[(3- chlorophenyl)carbamoyl]amino}- 3,3,3- trifluoro- 2- (1H- indol- 3- yl)propanoate
Smiles: COC(=O)C(C(F)(F)F)(c1c[nH]c2c1cccc2)NC(=O)Nc1cccc(c1)Cl

STK680949
Synonyms: N- (4- fluorophenyl)- 2- oxo- 2,3- dihydro- 1,3- benzothiazole- 6- sulfonamide
Smiles: Fc1ccc(cc1)NS(=O)(=O)c1ccc2c(c1)sc(=O)[nH]2

STK680950
Synonyms: 8,9- diethoxy- 4- (3- ethoxy- 4- methoxyphenyl)- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1ccc(c(c1)OCC)OC

STK771895
Synonyms: ethyl1- [4- (acetylamino)- 1,2,5- oxadiazol- 3- yl]- 6- amino- 4- (2- chloro- 6- fluorophenyl)- 5- cyano- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)N(c2nonc2NC(=O)C)C(=C(C1c1c(F)cccc1Cl)C#N)N

STK680952
Synonyms: 8,9- diethoxy- 4- (4- nitrophenyl)- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1ccc(cc1)[N+](=O)[O-]

STK680953
Synonyms: 4- (8,9- diethoxy- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepin- 4- yl)- 2- ethoxyphenol
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1ccc(c(c1)OCC)O

STK680956
Synonyms: 2- chloro- 6,7- dimethoxy- 4- (4- methylpiperazin- 1- yl)quinazoline
Smiles: COc1cc2c(cc1OC)nc(nc2N1CCN(CC1)C)Cl

STK680958
Synonyms: 1H- cyclopenta[1,2- b:5,4- b']dipyridine- 2,5- dione
Smiles: O=C1c2cccnc2c2c1ccc(=O)[nH]2

STK680959
Synonyms: N- [(2E)- azepan- 2- ylidene]- 2,3- dihydro- 1,4- benzodioxin- 6- amine
Smiles: C1CCN/C(=N/c2ccc3c(c2)OCCO3)/CC1

STK771899
Synonyms: 3- hydroxy- 6,6- dimethyl- 1- (4- methylphenyl)- 3- (trifluoromethyl)- 3,5,6,7- tetrahydro- 1H- indole- 2,4- dione
Smiles: Cc1ccc(cc1)N1C2=C(C(C1=O)(O)C(F)(F)F)C(=O)CC(C2)(C)C

STK680961
Synonyms: 1- methylpiperidin- 4- yl6- methoxy- 2- oxo- 2H- chromene- 3- carboxylate
Smiles: COc1ccc2c(c1)cc(c(=O)o2)C(=O)OC1CCN(CC1)C

STK771908
Synonyms: ethyl3- {[(6- bromo- 2- oxo- 2H- chromen- 3- yl)carbonyl]amino}- 3- (4- methoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)c1cc2cc(Br)ccc2oc1=O

STK771909
Synonyms: 3- {[4- (3,4- dimethylphenyl)piperazin- 1- yl]carbonyl}- 6- nitro- 2H- chromen- 2- one
Smiles: O=C(c1cc2cc(ccc2oc1=O)[N+](=O)[O-])N1CCN(CC1)c1ccc(c(c1)C)C

STK771914
Synonyms: 1- (2,4- dimethylphenyl)- 4- [(2- methoxy- 5- methylphenyl)sulfonyl]piperazine
Smiles: COc1ccc(cc1S(=O)(=O)N1CCN(CC1)c1ccc(cc1C)C)C

STK771915
Synonyms: 1- (2,4- dimethylphenyl)- 4- [(4- fluorophenyl)sulfonyl]piperazine
Smiles: Fc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1C)C

STK771925
Synonyms: 5- [(4- benzylpiperazin- 1- yl)carbonyl]- 2- (4- methylphenyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)N1CCN(CC1)Cc1ccccc1

STK771928
Synonyms: 3- {[4- (2,4- dimethylphenyl)piperazin- 1- yl]carbonyl}- 8- methoxy- 2H- chromen- 2- one
Smiles: COc1cccc2c1oc(=O)c(c2)C(=O)N1CCN(CC1)c1ccc(cc1C)C

STK771929
Synonyms: N- [2- (2,7- dimethyl- 1H- indol- 3- yl)ethyl]- 8- methoxy- 2- oxo- 2H- chromene- 3- carboxamide
Smiles: COc1cccc2c1oc(=O)c(c2)C(=O)NCCc1c(C)[nH]c2c1cccc2C

STK771937
Synonyms: 4,4,6,6- tetramethyl- 5- [(thiophen- 2- ylcarbonyl)oxy]- 4,5,6,7- tetrahydro[1,2]oxazolo[4,3- c]pyridin- 3- amine
Smiles: O=C(c1cccs1)ON1C(C)(C)Cc2c(C1(C)C)c(N)on2

STK680967
Synonyms: 4- phenyl- 4,5- dihydro- 1,4- benzoxazepin- 3(2H)- one
Smiles: O=C1COc2c(CN1c1ccccc1)cccc2

STK771942
Synonyms: 2- methyl- 4- (4- methylphenyl)- 4,5- dihydro- 1,4- benzoxazepin- 3(2H)- one
Smiles: Cc1ccc(cc1)N1Cc2ccccc2OC(C1=O)C

STK680968
Synonyms: 4- (4- chlorophenyl)- 4,5- dihydro- 1,4- benzoxazepin- 3(2H)- one
Smiles: Clc1ccc(cc1)N1Cc2ccccc2OCC1=O

STK680969
Synonyms: 3- {[(2- hydroxyethyl)amino]methyl}quinolin- 2(1H)- one
Smiles: OCCNCc1cc2ccccc2[nH]c1=O

STK680970
Synonyms: 3- chloro- 5,7- dimethoxy- 4- methyl- 2H- chromen- 2- one
Smiles: COc1cc(OC)cc2c1c(C)c(c(=O)o2)Cl

STK771953
Synonyms: 3- chloro- N- [1- cyclohexyl- 6,6- dimethyl- 2,4- dioxo- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl]benzamide
Smiles: Clc1cccc(c1)C(=O)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)C1CCCCC1)C(F)(F)F

STK771956
Synonyms: N- {1- [2- (3,4- dimethoxyphenyl)ethyl]- 2,5- dioxo- 4- (trifluoromethyl)imidazolidin- 4- yl}- 2,2- dimethylpropanamide
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(C1=O)(NC(=O)C(C)(C)C)C(F)(F)F

STK771959
Synonyms: N- (4- chloro- 2,5- dimethoxyphenyl)- 2,5- dimethylthiophene- 3- sulfonamide
Smiles: COc1cc(Cl)c(cc1NS(=O)(=O)c1cc(sc1C)C)OC

STK771960
Synonyms: 5- [(2- ethylpiperidin- 1- yl)carbonyl]- 2- (4- methylphenyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: CCC1CCCCN1C(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)C

STK771964
Synonyms: N- (4- methoxyphenyl)- 2- ({4- methyl- 5- [(3- nitro- 1H- 1,2,4- triazol- 1- yl)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1C)Cn1cnc(n1)[N+](=O)[O-]

STK771967
Synonyms: N- (2,5- dimethoxyphenyl)- 2- ({4- methyl- 5- [(3- nitro- 1H- 1,2,4- triazol- 1- yl)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1C)Cn1cnc(n1)[N+](=O)[O-])OC

STK771968
Synonyms: 2- ({4- methyl- 5- [(3- nitro- 1H- 1,2,4- triazol- 1- yl)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- 1- phenylethanone
Smiles: Cn1c(SCC(=O)c2ccccc2)nnc1Cn1cnc(n1)[N+](=O)[O-]

STK680972
Synonyms: N- (4- ethoxyphenyl)- 2- ({4- ethyl- 5- [(3- nitro- 1H- 1,2,4- triazol- 1- yl)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1CC)Cn1cnc(n1)[N+](=O)[O-]

STK771976
Synonyms: N- [2- (7- chloro- 2- methyl- 1H- indol- 3- yl)ethyl]- 4- methoxy- 3- methylbenzenesulfonamide
Smiles: COc1ccc(cc1C)S(=O)(=O)NCCc1c(C)[nH]c2c1cccc2Cl

STK680974
Synonyms: 3- ({4- [(2- hydroxyethyl)amino]- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- yl}amino)- 3- (4- methylphenyl)propanoicacid
Smiles: OCCNc1nc(NC(c2ccc(cc2)C)CC(=O)O)nc(n1)N1CCOCC1

STK771984
Synonyms: 4- methyl- N- [(1- methyl- 1H- imidazol- 2- yl)methyl]- N- (propan- 2- yl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(C(C)C)Cc1nccn1C

STK680975
Synonyms: (5- methoxy- 2H- tetrazol- 2- yl)aceticacid
Smiles: COc1nnn(n1)CC(=O)O

STK680976
Synonyms: N- (4- iodophenyl)- 2- (4- methyl- 2- oxomorpholin- 3- yl)acetamide
Smiles: CN1CCOC(=O)C1CC(=O)Nc1ccc(cc1)I

STK680977
Synonyms: 2- [6,7- dimethoxy- 2- (4- methylpiperazin- 1- yl)quinazolin- 4- yl]hydrazinecarboxamide
Smiles: COc1cc2nc(nc(c2cc1OC)NNC(=O)N)N1CCN(CC1)C

STK771990
Synonyms: 2'- hydroxy- 1',2',6',10b'- tetrahydro- 3'H- spiro[cyclopentane- 1,5'- pyrrolo[2,1- a]isoquinolin]- 3'- one
Smiles: OC1CC2N(C1=O)C1(CCCC1)Cc1c2cccc1

STK771991
Synonyms: N- methyl- 2- (4H- 1,2,4- triazol- 3- yl)acetamide
Smiles: CNC(=O)Cc1nnc[nH]1

STK680982
Synonyms: 1- benzyl- 3- (2- hydroxy- 3- methoxyphenyl)- 4,6- dioxo- 5- (propan- 2- yl)octahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: COc1cccc(c1O)C1NC(C2C1C(=O)N(C2=O)C(C)C)(Cc1ccccc1)C(=O)O

STK680984
Synonyms: 3- (2- hydroxy- 3- methoxyphenyl)- 1- (2- methylpropyl)- 4,6- dioxo- 5- (propan- 2- yl)octahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: COc1cccc(c1O)C1NC(C2C1C(=O)N(C2=O)C(C)C)(CC(C)C)C(=O)O

STK680985
Synonyms: 3- (2- hydroxy- 3- methoxyphenyl)- 1- methyl- 4,6- dioxo- 5- (propan- 2- yl)octahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: COc1cccc(c1O)C1NC(C2C1C(=O)N(C2=O)C(C)C)(C)C(=O)O

STK771993
Synonyms: N- benzyl- 2- (4H- 1,2,4- triazol- 3- yl)acetamide
Smiles: O=C(Cc1nnc[nH]1)NCc1ccccc1

STK680987
Synonyms: N- (2- phenylethyl)- 2- (4H- 1,2,4- triazol- 3- yl)acetamide
Smiles: O=C(Cc1nnc[nH]1)NCCc1ccccc1

STK771997
Synonyms: 2,4- dichloro- N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]benzamide
Smiles: CCOc1nc(NC(=O)NC(=O)c2ccc(cc2Cl)Cl)nc(n1)c1ccccc1

STK771998
Synonyms: N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]- 4- fluorobenzamide
Smiles: CCOc1nc(NC(=O)NC(=O)c2ccc(cc2)F)nc(n1)c1ccccc1

STK772001
Synonyms: 2,5- dimethyl- N- [3- (trifluoromethyl)phenyl]thiophene- 3- sulfonamide
Smiles: Cc1sc(c(c1)S(=O)(=O)Nc1cccc(c1)C(F)(F)F)C

STK772005
Synonyms: 1- [(4- chloro- 3- nitrophenyl)carbonyl]imidazolidin- 2- one
Smiles: O=C1NCCN1C(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STK772006
Synonyms: 1- [(4- chlorophenyl)sulfonyl]imidazolidin- 2- one
Smiles: O=C1NCCN1S(=O)(=O)c1ccc(cc1)Cl

STK680988
Synonyms: 3- ({[4- (acetylamino)phenyl]sulfonyl}amino)- 3- (4- propoxyphenyl)propanoicacid
Smiles: CCCOc1ccc(cc1)C(NS(=O)(=O)c1ccc(cc1)NC(=O)C)CC(=O)O

STK680993
Synonyms: 3- {[(4- tert- butylphenyl)carbonyl]amino}- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NC(=O)c1ccc(cc1)C(C)(C)C

STK772007
Synonyms: 1,3- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydropteridin- 6- ylacetate
Smiles: CC(=O)Oc1cnc2c(n1)c(=O)n(c(=O)n2C)C

STK772008
Synonyms: 6- methoxy- 1,3- dimethylpteridine- 2,4(1H,3H)- dione
Smiles: COc1cnc2c(n1)c(=O)n(c(=O)n2C)C

STK680995
Synonyms: 4,5- dihydroxy- 1- pentofuranosylpyrimidin- 2(1H)- one
Smiles: OCC1OC(C(C1O)O)n1cc(O)c(nc1=O)O

STK680996
Synonyms: 1- (3- O- acetyl- 2- deoxypentofuranosyl)- 4- [(phenylcarbonyl)amino]pyrimidin- 2(1H)- one
Smiles: OCC1OC(CC1OC(=O)C)n1ccc(nc1=O)NC(=O)c1ccccc1

STK680997
Synonyms: 1- (2- deoxy- 3- O- hexadecanoylpentofuranosyl)- 4- hydroxy- 5- methylpyrimidin- 2(1H)- one
Smiles: CCCCCCCCCCCCCCCC(=O)OC1CC(OC1CO)n1cc(C)c(nc1=O)O

STK772011
Synonyms: 2- chloro- N- {[2- oxo- 3- (trifluoromethyl)hexahydro- 2H- cyclopenta[b]furan- 3- yl]carbamoyl}benzenesulfonamide
Smiles: O=C(NS(=O)(=O)c1ccccc1Cl)NC1(C(=O)OC2C1CCC2)C(F)(F)F

STK772012
Synonyms: 2- methyl- N- ({4- [3- (trifluoromethyl)phenyl]- 1,3- thiazol- 2- yl}carbamoyl)benzenesulfonamide
Smiles: O=C(NS(=O)(=O)c1ccccc1C)Nc1scc(n1)c1cccc(c1)C(F)(F)F

STK680998
Synonyms: 3- methyl- 2- [(3- methyl- 2- {[(2,2,7,7- tetramethyltetrahydro- 3aH- bis[1,3]dioxolo[4,5- b:4',5'- d]pyran- 5- yl)carbonyl]amino}butanoyl)amino]butanoicacid(non- preferredname)
Smiles: CC(C(C(=O)NC(C(=O)O)C(C)C)NC(=O)C1OC2OC(OC2C2C1OC(O2)(C)C)(C)C)C

STK772014
Synonyms: 4- chloro- N- (2- cyano- 4,5- diethoxyphenyl)benzamide
Smiles: CCOc1cc(NC(=O)c2ccc(cc2)Cl)c(cc1OCC)C#N

STK681002
Synonyms: 5- chloro- N- (2- cyano- 4,5- diethoxyphenyl)- 2- methoxybenzamide
Smiles: CCOc1cc(NC(=O)c2cc(Cl)ccc2OC)c(cc1OCC)C#N

STK681005
Synonyms: N- (2- cyano- 4,5- diethoxyphenyl)- 1- methyl- 1H- pyrazole- 5- carboxamide
Smiles: CCOc1cc(NC(=O)c2ccnn2C)c(cc1OCC)C#N

STK681007
Synonyms: (5- amino- 3- methyl- 4- phenyl- 1H- pyrazol- 1- yl)(thiophen- 2- yl)methanone
Smiles: Cc1nn(c(c1c1ccccc1)N)C(=O)c1cccs1

STK772018
Synonyms: (5- amino- 3- methyl- 4- phenyl- 1H- pyrazol- 1- yl)(1H- indol- 3- yl)methanone
Smiles: Cc1nn(c(c1c1ccccc1)N)C(=O)c1c[nH]c2c1cccc2

STK772019
Synonyms: phenyl[(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]sulfamate
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)Oc2ccccc2)nc(n1)c1ccccc1

STK772020
Synonyms: 2- fluorophenyl[(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]sulfamate
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)Oc2ccccc2F)nc(n1)c1ccccc1

STK772021
Synonyms: 3- chloro- N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]benzenesulfonamide
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2cccc(c2)Cl)nc(n1)c1ccccc1

STK772022
Synonyms: N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]- 2,6- difluorobenzamide
Smiles: CCOc1nc(NC(=O)NC(=O)c2c(F)cccc2F)nc(n1)c1ccccc1

STK681008
Synonyms: 2- (benzylamino)- N- (3- fluorophenyl)pyridine- 3- carboxamide
Smiles: Fc1cccc(c1)NC(=O)c1cccnc1NCc1ccccc1

STK772025
Synonyms: 2,6- difluoro- N- {[4- phenyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}benzamide
Smiles: O=C(NC(=O)c1c(F)cccc1F)Nc1nc(cc(n1)C(F)(F)F)c1ccccc1

STK772026
Synonyms: phenyl{[4- phenyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}sulfamate
Smiles: O=C(NS(=O)(=O)Oc1ccccc1)Nc1nc(cc(n1)C(F)(F)F)c1ccccc1

STK681010
Synonyms: (1R)- octahydro- 2H- quinolizin- 1- ylmethyl[(4- fluorophenoxy)sulfonyl]carbamate
Smiles: O=C(NS(=O)(=O)Oc1ccc(cc1)F)OC[C@@H]1CCCN2C1CCCC2

STK681011
Synonyms: (1R)- octahydro- 2H- quinolizin- 1- ylmethyl[(2- fluorophenoxy)sulfonyl]carbamate
Smiles: O=C(NS(=O)(=O)Oc1ccccc1F)OC[C@@H]1CCCN2C1CCCC2

STK681012
Synonyms: (1R)- octahydro- 2H- quinolizin- 1- ylmethyl[(3- fluorophenoxy)sulfonyl]carbamate
Smiles: O=C(NS(=O)(=O)Oc1cccc(c1)F)OC[C@@H]1CCCN2C1CCCC2

STK681013
Synonyms: 3,3,5,8- tetramethyl- 3,4- dihydroisoquinolin- 1(2H)- one
Smiles: Cc1ccc(c2c1CC(C)(C)NC2=O)C

STK772027
Synonyms: (3,3,5- trimethyl- 3,4- dihydroisoquinolin- 1(2H)- ylidene)propanedinitrile
Smiles: N#CC(=C1NC(C)(C)Cc2c1cccc2C)C#N

STK681014
Synonyms: 1,3,3,6,10- pentamethyl- 8- (2,5,5- trimethyl- 4,5- dihydro- 3H- pyrrol- 3- ylidene)- 2- azaspiro[4.5]deca- 1,6,9- triene
Smiles: CC1=NC(C/C/1=C\1/C=C(C)C2(C(=C1)C)CC(N=C2C)(C)C)(C)C

STK772030
Synonyms: 2- [(4- fluorophenyl)amino]- N- phenylpyridine- 3- carboxamide
Smiles: Fc1ccc(cc1)Nc1ncccc1C(=O)Nc1ccccc1

STK772031
Synonyms: N- (4- chlorophenyl)- 2- [(3- fluorophenyl)amino]pyridine- 3- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1cccnc1Nc1cccc(c1)F

STK681015
Synonyms: 4- (4- chlorophenyl)- 8,9- diethoxy- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1ccc(cc1)Cl

STK681018
Synonyms: 1- [(4- chloronaphthalen- 1- yl)sulfonyl]- 4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)piperazine
Smiles: Clc1ccc(c2c1cccc2)S(=O)(=O)N1CCN(CC1)C12CC3CC(C2)CC(C1)C3

STK681019
Synonyms: 2- {1- [(1- hydroxybutan- 2- yl)amino]- 2- (naphthalen- 1- yl)ethylidene}- 5,5- dimethylcyclohexane- 1,3- dione
Smiles: CCC(NC(=C1C(=O)CC(CC1=O)(C)C)Cc1cccc2c1cccc2)CO

STK772036
Synonyms: methyl4- {2- [(2- methoxyphenyl)amino]- 4,4- dimethyl- 6- oxocyclohex- 1- en- 1- yl}- 4- oxobutanoate
Smiles: COC(=O)CCC(=O)C1=C(Nc2ccccc2OC)CC(CC1=O)(C)C

STK681020
Synonyms: methyl4- (2- amino- 4,4- dimethyl- 6- oxocyclohex- 1- en- 1- yl)- 4- oxobutanoate
Smiles: COC(=O)CCC(=O)C1=C(N)CC(CC1=O)(C)C

STK772038
Synonyms: 1- phenyl- 5- (propan- 2- yloxy)- 1H- tetrazole
Smiles: CC(Oc1nnnn1c1ccccc1)C

STK772048
Synonyms: 3a'- (4- fluorophenyl)dihydrodispiro[cyclopentane- 1,3'- furo[3,2- b]furan- 6',1''- cyclopentane]- 2',5'- dione
Smiles: Fc1ccc(cc1)C12OC(=O)C3(C1OC(=O)C12CCCC1)CCCC3

STK681022
Synonyms: N- (4- methoxyphenyl)- 2- (3- thioxo- 6,7- dihydro- 3H- pyrrolo[2,1- c][1,2,4]triazol- 2(5H)- yl)acetamide
Smiles: COc1ccc(cc1)NC(=O)Cn1nc2n(c1=S)CCC2

STK681024
Synonyms: 9- [2,3- O- (ethoxymethylidene)pentofuranosyl]- 9H- purin- 6- amine
Smiles: CCOC1OC2C(O1)C(OC2n1cnc2c1ncnc2N)CO

STK681025
Synonyms: 1- (2- deoxypentofuranosyl)- 4- hydroxypyrimidin- 2(1H)- one
Smiles: OCC1OC(CC1O)n1ccc(nc1=O)O

STK772051
Synonyms: 1- [2- deoxy- 3- O- (2- methylpropanoyl)pentofuranosyl]- 4- [(phenylcarbonyl)amino]pyrimidin- 2(1H)- one
Smiles: OCC1OC(CC1OC(=O)C(C)C)n1ccc(nc1=O)NC(=O)c1ccccc1

STK681026
Synonyms: (1E)- N'- [(4- chlorophenyl)sulfonyl]- N- (4- hydroxy- 2,3- dimethylphenyl)ethanimidamide
Smiles: Clc1ccc(cc1)S(=O)(=O)/N=C(/Nc1ccc(c(c1C)C)O)\C

STK772052
Synonyms: (1E)- N'- [(4- chlorophenyl)sulfonyl]- N- (4- hydroxy- 3,5- dimethylphenyl)ethanimidamide
Smiles: Clc1ccc(cc1)S(=O)(=O)/N=C(/Nc1cc(C)c(c(c1)C)O)\C

STK772053
Synonyms: N- (3- methoxyphenyl)- 7,7- dimethyl- 2- oxo- 1,8- dioxaspiro[4.5]decane- 4- carboxamide
Smiles: COc1cccc(c1)NC(=O)C1CC(=O)OC21CCOC(C2)(C)C

STK772054
Synonyms: 7,7- dimethyl- 2- oxo- N- (2- phenylethyl)- 1,8- dioxaspiro[4.5]decane- 4- carboxamide
Smiles: O=C1CC(C2(O1)CCOC(C2)(C)C)C(=O)NCCc1ccccc1

STK681029
Synonyms: 6- (2,2,2- trifluoroethoxy)tetrazolo[1,5- b]pyridazine
Smiles: FC(COc1ccc2n(n1)nnn2)(F)F

STK772055
Synonyms: methyl2- {[(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]sulfamoyl}benzoate
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2ccccc2C(=O)OC)nc(n1)c1ccccc1

STK681030
Synonyms: N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]- 3- (trifluoromethyl)benzenesulfonamide
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2cccc(c2)C(F)(F)F)nc(n1)c1ccccc1

STK772056
Synonyms: 3,5- dichloro- N- [(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]benzenesulfonamide
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)c2cc(Cl)cc(c2)Cl)nc(n1)c1ccccc1

STK681032
Synonyms: 7- (methoxymethyl)- 3- (4- methylphenyl)[1,2,4]triazolo[4,3- a]pyrimidin- 5(8H)- one
Smiles: COCc1cc(=O)n2c([nH]1)nnc2c1ccc(cc1)C

STK772058
Synonyms: (2Z)- 2- {[3- (thiophen- 2- yl)- 1H- pyrazol- 4- yl]methylidene}[1,3]thiazolo[3,2- a]benzimidazol- 3(2H)- one
Smiles: O=c1/c(=C/c2c[nH]nc2c2cccs2)/sc2n1c1ccccc1n2

STK772060
Synonyms: 3- chloro- 6- (2,2,2- trifluoroethoxy)pyridazine
Smiles: FC(COc1ccc(nn1)Cl)(F)F

STK681034
Synonyms: 3- ({2- [2- methyl- 5- (trifluoromethoxy)- 1H- indol- 3- yl]ethyl}amino)- 2- pentanoyl- 5- phenylcyclohex- 2- en- 1- one
Smiles: CCCCC(=O)C1=C(NCCc2c(C)[nH]c3c2cc(cc3)OC(F)(F)F)CC(CC1=O)c1ccccc1

STK681036
Synonyms: N- {4- [4,4- dimethyl- 6- oxo- 2- (prop- 2- en- 1- ylamino)cyclohex- 1- en- 1- yl]- 4- oxobutyl}- N'- (prop- 2- en- 1- yl)benzene- 1,2- dicarboxamide
Smiles: C=CCNC1=C(C(=O)CCCNC(=O)c2ccccc2C(=O)NCC=C)C(=O)CC(C1)(C)C

STK681037
Synonyms: 5'- (2- methoxyphenyl)- 3'- methyl- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COc1ccccc1N1C(=O)C2C(C1=O)C1(NC2C)C(=O)Nc2c1cccc2

STK681039
Synonyms: 5- butyl- 3- (2- hydroxyphenyl)- 1- (2- methylpropyl)- 4,6- dioxooctahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: CCCCN1C(=O)C2C(C1=O)C(NC2c1ccccc1O)(CC(C)C)C(=O)O

STK681042
Synonyms: 5,9,9- trimethyl- 3,4,4a,5,9,10- hexahydro- 1H- pyrido[1,2- a]quinoline- 6,7(2H,8H)- dione
Smiles: O=C1CC(C)(C)CC2=C1C(=O)C(C1N2CCCC1)C

STK772064
Synonyms: 4- amino- N- (2- phenylethyl)- 1,2,5- oxadiazole- 3- carboxamide
Smiles: O=C(c1nonc1N)NCCc1ccccc1

STK772067
Synonyms: ethyl3- (1,3- thiazol- 2- ylcarbamoyl)pyridine- 4- carboxylate
Smiles: CCOC(=O)c1ccncc1C(=O)Nc1nccs1

STK681045
Synonyms: 4,5- dimethoxy- 2- {[(4- methoxyphenyl)sulfonyl]amino}benzoicacid
Smiles: COc1ccc(cc1)S(=O)(=O)Nc1cc(OC)c(cc1C(=O)O)OC

STK681047
Synonyms: 3- (2- hydroxyphenyl)- 1- (2- methylpropyl)- 4,6- dioxo- 5- (propan- 2- yl)octahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: CC(CC1(NC(C2C1C(=O)N(C2=O)C(C)C)c1ccccc1O)C(=O)O)C

STK772071
Synonyms: 4- (thiophen- 2- yl)- 1- [2- (trifluoromethyl)phenyl]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CCCC2=C1C(CC(=O)N2c1ccccc1C(F)(F)F)c1cccs1

STK772073
Synonyms: 2,4,6- trimethyl- N- [2- (pyridin- 4- yl)ethyl]benzenesulfonamide
Smiles: Cc1cc(C)c(c(c1)C)S(=O)(=O)NCCc1ccncc1

STK772082
Synonyms: N- [(4S,5S)- 2,2- dimethyl- 4- phenyl- 1,3- dioxan- 5- yl]quinoline- 2- carboxamide
Smiles: O=C(c1ccc2c(n1)cccc2)N[C@H]1COC(O[C@H]1c1ccccc1)(C)C

STK772083
Synonyms: 4- chloro- N- [1- oxo- 1- (piperidin- 1- yl)propan- 2- yl]benzamide
Smiles: CC(C(=O)N1CCCCC1)NC(=O)c1ccc(cc1)Cl

STK772086
Synonyms: 4- methoxy- N- [1- oxo- 1- (piperidin- 1- yl)propan- 2- yl]quinoline- 2- carboxamide
Smiles: COc1cc(nc2c1cccc2)C(=O)NC(C(=O)N1CCCCC1)C

STK681048
Synonyms: 3- {4- ethoxy- 6- [(tetrahydrofuran- 2- ylmethyl)amino]- 1,3,5- triazin- 2- yl}- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: CCOc1nc(NCC2CCCO2)nc(n1)N1CC2CC(C1)c1n(C2)c(=O)ccc1

STK681049
Synonyms: 3- [4- methoxy- 6- (propan- 2- ylamino)- 1,3,5- triazin- 2- yl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: COc1nc(NC(C)C)nc(n1)N1CC2CC(C1)c1n(C2)c(=O)ccc1

STK681050
Synonyms: 3- [4- ethoxy- 6- (propan- 2- ylamino)- 1,3,5- triazin- 2- yl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: CCOc1nc(NC(C)C)nc(n1)N1CC2CC(C1)c1n(C2)c(=O)ccc1

STK772089
Synonyms: 3- [4- (propan- 2- ylamino)- 6- (pyrrolidin- 1- yl)- 1,3,5- triazin- 2- yl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: CC(Nc1nc(nc(n1)N1CCCC1)N1CC2CC(C1)c1n(C2)c(=O)ccc1)C

STK772094
Synonyms: N- ethyl- 1- (ethylsulfanyl)- 9,10- dioxo- 9,10- dihydroanthracene- 2- carboxamide
Smiles: CCNC(=O)c1ccc2c(c1SCC)C(=O)c1c(C2=O)cccc1

STK772095
Synonyms: 2- (3- methoxyphenyl)- 1H- pyrrolo[3,4- c]pyridine- 1,3(2H)- dione
Smiles: COc1cccc(c1)N1C(=O)c2c(C1=O)cncc2

STK772096
Synonyms: 2- cyclohexyl- 1H- pyrrolo[3,4- c]pyridine- 1,3(2H)- dione
Smiles: O=C1c2cnccc2C(=O)N1C1CCCCC1

STK681052
Synonyms: 4- [3- (trifluoromethyl)phenyl]- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: FC(c1cccc(c1)C1NCc2c(n3c1ccc3)cccc2)(F)F

STK772097
Synonyms: 1- (butylsulfanyl)- N- methyl- 9,10- dioxo- 9,10- dihydroanthracene- 2- carboxamide
Smiles: CCCCSc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)NC

STK772098
Synonyms: 1- (butylsulfanyl)- N- (3- fluorophenyl)- 9,10- dioxo- 9,10- dihydroanthracene- 2- carboxamide
Smiles: CCCCSc1c(ccc2c1C(=O)c1c(C2=O)cccc1)C(=O)Nc1cccc(c1)F

STK772099
Synonyms: N- (2- chloroethyl)- 1- nitro- 9,10- dioxo- 9,10- dihydroanthracene- 2- carboxamide
Smiles: ClCCNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1c(C2=O)cccc1

STK772102
Synonyms: 1,1'- (pyridine- 2,6- diyldicarbonyl)diazepan- 2- one
Smiles: O=C1CCCCCN1C(=O)c1cccc(n1)C(=O)N1CCCCCC1=O

STK681053
Synonyms: 6,8- dichloro- N- [2- (5- fluoro- 2- methyl- 1H- indol- 3- yl)ethyl]- 2- oxo- 2H- chromene- 3- carboxamide
Smiles: Fc1ccc2c(c1)c(CCNC(=O)c1cc3cc(Cl)cc(c3oc1=O)Cl)c([nH]2)C

STK772104
Synonyms: 4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- [5- methoxy- 2- (phenylcarbonyl)- 1- benzofuran- 3- yl]butanamide
Smiles: COc1ccc2c(c1)c(NC(=O)CCCN1C(=O)c3c(C1=O)cccc3)c(o2)C(=O)c1ccccc1

STK681056
Synonyms: 3- chlorophenyl[(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]sulfamate
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)Oc2cccc(c2)Cl)nc(n1)c1ccccc1

STK772105
Synonyms: 3- chlorophenyl{[4- phenyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}sulfamate
Smiles: Clc1cccc(c1)OS(=O)(=O)NC(=O)Nc1nc(cc(n1)C(F)(F)F)c1ccccc1

STK681058
Synonyms: (4- tert- butylphenyl){4- [(2- methyl- 1,3- thiazol- 4- yl)methyl]piperazin- 1- yl}methanone
Smiles: Cc1scc(n1)CN1CCN(CC1)C(=O)c1ccc(cc1)C(C)(C)C

STK772106
Synonyms: 1- butyl- 5a,10,10- trihydroxy- 4- phenyl- 5a,10- dihydro- 1H- indeno[1',2':2,3]furo[3,4- b]pyrrole- 2,3- dione
Smiles: CCCCN1C(=O)C(=O)C2=C(OC3(C12C(O)(O)c1c3cccc1)O)c1ccccc1

STK681059
Synonyms: 1,4- bis(2,6- dimethylpyridin- 4- yl)piperazine
Smiles: Cc1cc(cc(n1)C)N1CCN(CC1)c1cc(C)nc(c1)C

STK681060
Synonyms: 3- (4- ethoxy- 3- methoxyphenyl)- 3- {[(4- methoxyphenyl)carbonyl]amino}propanoicacid
Smiles: CCOc1ccc(cc1OC)C(NC(=O)c1ccc(cc1)OC)CC(=O)O

STK681062
Synonyms: 3- [(2- phenylbutanoyl)amino]- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: CCC(C(=O)NC(c1ccc(cc1)OC(C)C)CC(=O)O)c1ccccc1

STK681064
Synonyms: 3- {[(4- chlorophenyl)acetyl]amino}- 3- (4- ethoxyphenyl)propanoicacid
Smiles: CCOc1ccc(cc1)C(CC(=O)O)NC(=O)Cc1ccc(cc1)Cl

STK681067
Synonyms: 3- (4- ethoxyphenyl)- 3- [(3- phenylbutanoyl)amino]propanoicacid
Smiles: CCOc1ccc(cc1)C(CC(=O)O)NC(=O)CC(c1ccccc1)C

STK772112
Synonyms: ethyl(2E)- cyano(1- phenyl- 1,4- dihydro- 5H- tetrazol- 5- ylidene)ethanoate
Smiles: CCOC(=O)/C(=c/1\[nH]nnn1c1ccccc1)/C#N

STK681069
Synonyms: 3- [4- (2- amino- 2- oxoethoxy)- 3- methoxyphenyl]- 3- [(phenylacetyl)amino]propanoicacid
Smiles: COc1cc(ccc1OCC(=O)N)C(NC(=O)Cc1ccccc1)CC(=O)O

STK681070
Synonyms: 3- [4- (2- amino- 2- oxoethoxy)- 3- methoxyphenyl]- 3- {[(2- bromophenyl)carbonyl]amino}propanoicacid
Smiles: COc1cc(ccc1OCC(=O)N)C(NC(=O)c1ccccc1Br)CC(=O)O

STK772117
Synonyms: 2- acetyl- 1- (ethylsulfanyl)- 5,6,7,8- tetrahydro- 3H- pyrrolo[1,2- a]indol- 3- one
Smiles: CCSC1=C(C(=O)C)C(=O)n2c1cc1c2CCCC1

STK772118
Synonyms: ethyl1- (ethylsulfanyl)- 3- oxo- 5- phenyl- 3H- pyrrolizine- 2- carboxylate
Smiles: CCOC(=O)C1=C(SCC)c2n(C1=O)c(cc2)c1ccccc1

STK772120
Synonyms: 2- acetyl- 5- phenyl- 1- (piperidin- 1- yl)- 3H- pyrrolizin- 3- one
Smiles: CC(=O)C1=C(N2CCCCC2)c2n(C1=O)c(cc2)c1ccccc1

STK772122
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (4- ethoxyphenyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)OCC

STK772123
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (4- fluorophenyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccc(cc1)F)c1nonc1N

STK681072
Synonyms: 3- imino- 1,1- dimethoxy- 2,3,4,7- tetrahydro- 1H- 4,7- ethanoisoindole- 3a,7a- dicarbonitrile
Smiles: N#CC12C3CCC(C2(C#N)C(=N)NC1(OC)OC)C=C3

STK772126
Synonyms: 4- formyl- 3,5- dimethyl- 1H- pyrrole- 2- carbonitrile
Smiles: O=Cc1c(C)[nH]c(c1C)C#N

STK681076
Synonyms: [(1- benzyl- 1H- indol- 3- yl)sulfanyl]aceticacid
Smiles: OC(=O)CSc1cn(c2c1cccc2)Cc1ccccc1

STK772127
Synonyms: N- (2- methylbut- 3- yn- 2- yl)acetamide
Smiles: C#CC(NC(=O)C)(C)C

STK772128
Synonyms: 4- hydroxy- 6- methyl- 2H- pyran- 2- one
Smiles: Oc1cc(C)oc(=O)c1

STK681078
Synonyms: (2E,5E)- 2,6- bis(benzylamino)hepta- 2,5- dien- 4- one
Smiles: O=C(/C=C(/NCc1ccccc1)\C)/C=C(/NCc1ccccc1)\C

STK772129
Synonyms: 5- amino- 1- (2- fluorophenyl)- N- [3- (trifluoromethyl)phenyl]- 1H- pyrazole- 4- carboxamide
Smiles: O=C(c1cnn(c1N)c1ccccc1F)Nc1cccc(c1)C(F)(F)F

STK772131
Synonyms: 5- amino- 1- (4- methoxybenzyl)- N- [4- (trifluoromethoxy)phenyl]- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: COc1ccc(cc1)Cn1nnc(c1N)C(=O)Nc1ccc(cc1)OC(F)(F)F

STK772133
Synonyms: 5- amino- 1- (4- methoxybenzyl)- N- [3- (trifluoromethyl)phenyl]- 1H- pyrazole- 4- carboxamide
Smiles: COc1ccc(cc1)Cn1ncc(c1N)C(=O)Nc1cccc(c1)C(F)(F)F

STK772136
Synonyms: 3- nitrodibenzo[b,f][1,4]oxazepin- 11(10H)- one
Smiles: O=C1Nc2ccccc2Oc2c1ccc(c2)[N+](=O)[O-]

STK681081
Synonyms: N- [4- (benzyloxy)phenyl]- 2- cyanoacetamide
Smiles: N#CCC(=O)Nc1ccc(cc1)OCc1ccccc1

STK681082
Synonyms: N- methyl- 4- (trifluoromethoxy)aniline
Smiles: CNc1ccc(cc1)OC(F)(F)F

STK681083
Synonyms: 4- [chloro(difluoro)methoxy]- N- methylaniline
Smiles: CNc1ccc(cc1)OC(Cl)(F)F

STK772138
Synonyms: 5- amino- 3- methyl- 1,2- oxazole- 4- carbonitrile
Smiles: N#Cc1c(N)onc1C

STK681084
Synonyms: 2,8- diazaspiro[5.5]undecane- 1,7- dione
Smiles: O=C1NCCCC21CCCNC2=O

STK681085
Synonyms: 3- (2- aminoethyl)- 1H- indole- 2- carboxylicacid
Smiles: NCCc1c([nH]c2c1cccc2)C(=O)O

STK772139
Synonyms: 5- amino- N- (2- fluorophenyl)- 3- methyl- 1,2- oxazole- 4- carboxamide
Smiles: Fc1ccccc1NC(=O)c1c(N)onc1C

STK772140
Synonyms: methyl5- nitro- 2H- 1,2,3- triazole- 4- carboxylate
Smiles: [O-][N+](=O)c1n[nH]nc1C(=O)OC

STK772142
Synonyms: 5- amino- 3- methyl- N- (4- methylphenyl)- 1,2- oxazole- 4- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1c(C)noc1N

STK772143
Synonyms: 5- amino- 1- (propan- 2- yl)- 1H- pyrazole- 4- carboxamide
Smiles: CC(n1ncc(c1N)C(=O)N)C

STK772144
Synonyms: (3- methyl- 1H- 1,2,4- triazol- 5- yl)acetonitrile
Smiles: Cc1nc([nH]n1)CC#N

STK681089
Synonyms: 3- (2- aminoethyl)- 5- methyl- 1H- indole- 2- carboxylicacid
Smiles: Cc1cc2c(CCN)c([nH]c2cc1)C(=O)O

STK681090
Synonyms: 1,2,3- trimethylpiperidin- 4- one
Smiles: CN1CCC(=O)C(C1C)C

STK681092
Synonyms: 1,10- phenanthroline- 5,6- dione
Smiles: O=C1C(=O)c2cccnc2c2c1cccn2

STK681093
Synonyms: 3- (2- aminoethyl)- 5- chloro- 1H- indole- 2- carboxylicacid
Smiles: NCCc1c(C(=O)O)[nH]c2c1cc(Cl)cc2

STK772145
Synonyms: 5- amino- N- (4- fluorophenyl)- 3- methyl- 1,2- oxazole- 4- carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1c(N)onc1C

STK681095
Synonyms: 1- (3,5- dimethyltricyclo[3.3.1.1~3,7~]dec- 1- yl)methanamine
Smiles: NCC12CC3CC(C2)(CC(C1)(C3)C)C

STK772148
Synonyms: 5,5'- sulfanediylbis(4- cyclopropyl- 1,3- thiazol- 2- amine)
Smiles: Nc1sc(c(n1)C1CC1)Sc1sc(nc1C1CC1)N

STK772149
Synonyms: 6- ethoxy- 2,2,4- trimethyl- 1,2- dihydroquinoline
Smiles: CCOc1ccc2c(c1)C(=CC(N2)(C)C)C

STK681096
Synonyms: 5- methyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazole- 4- carbaldehyde
Smiles: O=Cc1c(C)[nH]n(c1=O)c1ccccc1

STK681097
Synonyms: 4- chlorodecahydroquinoline
Smiles: ClC1CCNC2C1CCCC2

STK681098
Synonyms: 1,4- dimethyldecahydroquinolin- 4- ol
Smiles: CN1CCC(C2C1CCCC2)(C)O

STK772150
Synonyms: (4- hydroxyoctahydroquinolin- 1(2H)- yl)(phenyl)methanone
Smiles: OC1CCN(C2C1CCCC2)C(=O)c1ccccc1

STK772151
Synonyms: 1- (4- hydroxyoctahydroquinolin- 1(2H)- yl)ethanone
Smiles: OC1CCN(C2C1CCCC2)C(=O)C

STK681099
Synonyms: 1H- [1,2,3]triazolo[4,5- d]pyridazine- 4,7- diol
Smiles: Oc1nnc(c2c1[nH]nn2)O

STK772152
Synonyms: 6- amino- 1,3- benzodioxole- 5- carbonitrile
Smiles: N#Cc1cc2OCOc2cc1N

STK772153
Synonyms: N'- [(6- methyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)sulfonyl]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)NNS(=O)(=O)c1c(C)[nH]c(=O)[nH]c1=O

STK681100
Synonyms: 1- benzyl- 2,3- dimethylpiperidin- 4- one
Smiles: CC1N(CCC(=O)C1C)Cc1ccccc1

STK681101
Synonyms: 1- cyclopropyl- 2,3- dimethylpiperidin- 4- one
Smiles: O=C1CCN(C(C1C)C)C1CC1

STK681102
Synonyms: 2,3- dimethyl- 1- (2- phenylethyl)piperidin- 4- one
Smiles: CC1N(CCc2ccccc2)CCC(=O)C1C

STK681103
Synonyms: 1- (furan- 2- ylmethyl)- 2,3- dimethylpiperidin- 4- one
Smiles: O=C1CCN(C(C1C)C)Cc1ccco1

STK681104
Synonyms: 2,3- dimethyl- 1- (propan- 2- yl)piperidin- 4- one
Smiles: O=C1CCN(C(C1C)C)C(C)C

STK681105
Synonyms: 1- (2- methoxyethyl)- 2,3- dimethylpiperidin- 4- one
Smiles: CC1C(C)C(=O)CCN1CCOC

STK772155
Synonyms: 1- (2- ethoxyphenyl)- 3- methyl- 4- phenyl- 1H- pyrazol- 5- amine
Smiles: CCOc1ccccc1n1nc(c(c1N)c1ccccc1)C

STK681106
Synonyms: 3- phenyl- 3- (1H- pyrrol- 1- yl)propanoicacid
Smiles: OC(=O)CC(n1cccc1)c1ccccc1

STK681107
Synonyms: 1- (2- aminoethyl)- 3- hydroxy- 5- phenyl- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: NCCN1C(=O)C(=C(C1c1ccccc1)C(=O)c1ccccc1)O

STK681108
Synonyms: 1- (2- hydroxyethyl)- 2,3- dimethylpiperidin- 4- one
Smiles: CC1C(C)C(=O)CCN1CCO

STK772157
Synonyms: 5- amino- 3- methyl- N- [4- (trifluoromethyl)phenyl]- 1,2- oxazole- 4- carboxamide
Smiles: O=C(c1c(N)onc1C)Nc1ccc(cc1)C(F)(F)F

STK772158
Synonyms: ethyl1H- 1,2,4- triazol- 5- ylacetate
Smiles: CCOC(=O)Cc1ncn[nH]1

STK681120
Synonyms: 8,9- diethoxy- 4- [4- (propan- 2- yl)phenyl]- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1ccc(cc1)C(C)C

STK681121
Synonyms: 8,9- diethoxy- 4- (4- fluoro- 3- methoxyphenyl)- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1ccc(c(c1)OC)F

STK681123
Synonyms: 3- {[(2- chlorophenyl)carbonyl]amino}- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC(C)C)NC(=O)c1ccccc1Cl

STK681124
Synonyms: 3- {[(4- chlorophenyl)acetyl]amino}- 3- [4- (propan- 2- yloxy)phenyl]propanoicacid
Smiles: CC(Oc1ccc(cc1)C(CC(=O)O)NC(=O)Cc1ccc(cc1)Cl)C

STK681126
Synonyms: 3- (4- ethoxyphenyl)- 3- [(2- phenoxypropanoyl)amino]propanoicacid
Smiles: CCOc1ccc(cc1)C(NC(=O)C(Oc1ccccc1)C)CC(=O)O

STK772164
Synonyms: 3- [(2- methylphenyl)amino]- 1,5- diphenyl- 4- (thiophen- 2- ylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: O=C(C1=C(Nc2ccccc2C)C(=O)N(C1c1ccccc1)c1ccccc1)c1cccs1

STK772165
Synonyms: 4- (furan- 2- ylcarbonyl)- 3- [(4- methylphenyl)amino]- 1,5- diphenyl- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)NC1=C(C(=O)c2ccco2)C(N(C1=O)c1ccccc1)c1ccccc1

STK681128
Synonyms: 3,3- dimethyl- 1- (pyrrolidin- 1- yl)butan- 2- ol
Smiles: OC(C(C)(C)C)CN1CCCC1

STK681129
Synonyms: 1- phenyl- 2- (1H- pyrazol- 1- yl)ethanamine
Smiles: NC(c1ccccc1)Cn1cccn1

STK681130
Synonyms: 3,3- dimethyl- 1- (pyrrolidin- 1- yl)butan- 2- ylacetate
Smiles: CC(=O)OC(C(C)(C)C)CN1CCCC1

STK681131
Synonyms: 8,9- diethoxy- 4- [4- (trifluoromethoxy)phenyl]- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1ccc(cc1)OC(F)(F)F

STK681132
Synonyms: 8,9- diethoxy- 4- (4- fluorophenyl)- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1ccc(cc1)F

STK772176
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- {[(2- hydroxyethyl)sulfanyl]methyl}- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: OCCSCc1c(nnn1c1nonc1N)C(=O)OCC

STK681133
Synonyms: 1- benzyl- 5a,10,10- trihydroxy- 4- methyl- 5a,10- dihydro- 1H- indeno[1',2':2,3]furo[3,4- b]pyrrole- 2,3- dione
Smiles: O=C1C(=O)C2=C(C)OC3(C2(N1Cc1ccccc1)C(O)(O)c1c3cccc1)O

STK772179
Synonyms: 6- (1H- pyrrol- 1- yl)- 1,3- benzodioxole- 5- carbonitrile
Smiles: N#Cc1cc2OCOc2cc1n1cccc1

STK772180
Synonyms: 2- [(5- methoxy- 1H- benzimidazol- 2- yl)sulfanyl]- N- (2- phenylimidazo[1,2- a]pyridin- 8- yl)acetamide
Smiles: COc1ccc2c(c1)nc([nH]2)SCC(=O)Nc1cccn2c1nc(c2)c1ccccc1

STK772183
Synonyms: N- (4- fluorophenyl)- 2,5- dimethylthiophene- 3- sulfonamide
Smiles: Fc1ccc(cc1)NS(=O)(=O)c1cc(sc1C)C

STK772187
Synonyms: 2- fluoro- N- {[4- phenyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}benzamide
Smiles: O=C(NC(=O)c1ccccc1F)Nc1nc(cc(n1)C(F)(F)F)c1ccccc1

STK772188
Synonyms: 2,4- dichloro- N- {[4- phenyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}benzamide
Smiles: O=C(NC(=O)c1ccc(cc1Cl)Cl)Nc1nc(cc(n1)C(F)(F)F)c1ccccc1

STK772190
Synonyms: 3,4- dichloro- N- {[4- (thiophen- 2- yl)- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}benzamide
Smiles: O=C(NC(=O)c1ccc(c(c1)Cl)Cl)Nc1nc(cc(n1)C(F)(F)F)c1cccs1

STK681136
Synonyms: 3- (4- ethoxyphenyl)- 3- {[(2- methoxyphenoxy)acetyl]amino}propanoicacid
Smiles: CCOc1ccc(cc1)C(CC(=O)O)NC(=O)COc1ccccc1OC

STK772191
Synonyms: N- (2- butoxyphenyl)- 2- {5- [4- (methylsulfanyl)phenyl]- 2H- tetrazol- 2- yl}acetamide
Smiles: CCCCOc1ccccc1NC(=O)Cn1nnc(n1)c1ccc(cc1)SC

STK772193
Synonyms: N- (2- butoxyphenyl)- 2- [5- (2- fluorophenyl)- 2H- tetrazol- 2- yl]acetamide
Smiles: CCCCOc1ccccc1NC(=O)Cn1nnc(n1)c1ccccc1F

STK681138
Synonyms: 4- [4- (difluoromethoxy)phenyl]- 8,9- diethoxy- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1ccc(cc1)OC(F)F

STK681139
Synonyms: 3- (8,9- diethoxy- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepin- 4- yl)- 4H- chromen- 4- one
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1coc2c(c1=O)cccc2

STK772195
Synonyms: (5- amino- 3- methyl- 4- phenyl- 1H- pyrazol- 1- yl)(1,3- benzodioxol- 5- yl)methanone
Smiles: Cc1nn(c(c1c1ccccc1)N)C(=O)c1ccc2c(c1)OCO2

STK772196
Synonyms: 4- chlorophenyl[(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]sulfamate
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)Oc2ccc(cc2)Cl)nc(n1)c1ccccc1

STK772200
Synonyms: (5- amino- 3- methyl- 4- phenyl- 1H- pyrazol- 1- yl)(4- fluorophenyl)methanone
Smiles: Fc1ccc(cc1)C(=O)n1nc(c(c1N)c1ccccc1)C

STK772202
Synonyms: (5- amino- 3- methyl- 4- phenyl- 1H- pyrazol- 1- yl)(2,4- dichlorophenyl)methanone
Smiles: Clc1ccc(c(c1)Cl)C(=O)n1nc(c(c1N)c1ccccc1)C

STK772203
Synonyms: (5- amino- 3- methyl- 4- phenyl- 1H- pyrazol- 1- yl)(3- chlorophenyl)methanone
Smiles: Clc1cccc(c1)C(=O)n1nc(c(c1N)c1ccccc1)C

STK772204
Synonyms: 1- (5- amino- 3- methyl- 4- phenyl- 1H- pyrazol- 1- yl)- 2- (2,4- dichlorophenoxy)ethanone
Smiles: Clc1ccc(c(c1)Cl)OCC(=O)n1nc(c(c1N)c1ccccc1)C

STK772206
Synonyms: 2- [(4- chlorophenyl)amino]- N- (4- methoxyphenyl)pyridine- 3- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1cccnc1Nc1ccc(cc1)Cl

STK681141
Synonyms: 8,9- diethoxy- 4- (3- nitrophenyl)- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1cccc(c1)[N+](=O)[O-]

STK681142
Synonyms: 4- (8,9- diethoxy- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepin- 4- yl)benzonitrile
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1ccc(cc1)C#N

STK681143
Synonyms: 8,9- diethoxy- 4- [3- (trifluoromethyl)phenyl]- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1cccc(c1)C(F)(F)F

STK681144
Synonyms: 8,9- diethoxy- 4- (4- methoxy- 2,5- dimethylphenyl)- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1cc(C)c(cc1C)OC

STK681145
Synonyms: 8,9- diethoxy- 4- (3- fluorophenyl)- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1cccc(c1)F

STK772213
Synonyms: 8,9- diethoxy- 4- [2- (trifluoromethyl)phenyl]- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1ccccc1C(F)(F)F

STK681146
Synonyms: 8,9- diethoxy- 4- (2- fluoro- 5- methoxyphenyl)- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1cc(OC)ccc1F

STK772215
Synonyms: 3- fluorophenyl[(4- ethoxy- 6- phenyl- 1,3,5- triazin- 2- yl)carbamoyl]sulfamate
Smiles: CCOc1nc(NC(=O)NS(=O)(=O)Oc2cccc(c2)F)nc(n1)c1ccccc1

STK772216
Synonyms: N- {2- [(thiophen- 2- ylacetyl)amino]phenyl}- 4- (trifluoromethyl)benzamide
Smiles: O=C(Nc1ccccc1NC(=O)c1ccc(cc1)C(F)(F)F)Cc1cccs1

STK772217
Synonyms: 3- chloro- N- {[4- phenyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}benzenesulfonamide
Smiles: Clc1cccc(c1)S(=O)(=O)NC(=O)Nc1nc(cc(n1)C(F)(F)F)c1ccccc1

STK681150
Synonyms: (1R)- octahydro- 2H- quinolizin- 1- ylmethyl(phenoxysulfonyl)carbamate
Smiles: O=C(NS(=O)(=O)Oc1ccccc1)OC[C@@H]1CCCN2C1CCCC2

STK772219
Synonyms: N- (4- sulfamoylbenzyl)- 4,5,6,7- tetrahydro- 2- benzothiophene- 1- carboxamide
Smiles: O=C(c1scc2c1CCCC2)NCc1ccc(cc1)S(=O)(=O)N

STK681152
Synonyms: (1E)- N- (4- hydroxy- 2,3- dimethylphenyl)- N'- [(4- methylphenyl)sulfonyl]ethanimidamide
Smiles: Cc1ccc(cc1)S(=O)(=O)/N=C(/Nc1ccc(c(c1C)C)O)\C

STK681153
Synonyms: (1E)- N- (4- hydroxy- 3,5- dimethylphenyl)- N'- [(4- methylphenyl)sulfonyl]ethanimidamide
Smiles: Cc1ccc(cc1)S(=O)(=O)/N=C(/Nc1cc(C)c(c(c1)C)O)\C

STK772224
Synonyms: 1- butyl- 4- (4- fluorophenyl)- 5a,10,10- trihydroxy- 5a,10- dihydro- 1H- indeno[1',2':2,3]furo[3,4- b]pyrrole- 2,3- dione
Smiles: CCCCN1C(=O)C(=O)C2=C(OC3(C12C(O)(O)c1c3cccc1)O)c1ccc(cc1)F

STK681157
Synonyms: 1- hexyl- 5a,10,10- trihydroxy- 4- methyl- 5a,10- dihydro- 1H- indeno[1',2':2,3]furo[3,4- b]pyrrole- 2,3- dione
Smiles: CCCCCCN1C(=O)C(=O)C2=C(OC3(C12C(O)(O)c1c3cccc1)O)C

STK772228
Synonyms: 4- (4- fluorophenyl)- 5a,10,10- trihydroxy- 1- (2- methylpropyl)- 5a,10- dihydro- 1H- indeno[1',2':2,3]furo[3,4- b]pyrrole- 2,3- dione
Smiles: CC(CN1C(=O)C(=O)C2=C(OC3(C12C(O)(O)c1c3cccc1)O)c1ccc(cc1)F)C

STK772231
Synonyms: 1- benzyl- 4- (4- fluorophenyl)- 5a,10,10- trihydroxy- 5a,10- dihydro- 1H- indeno[1',2':2,3]furo[3,4- b]pyrrole- 2,3- dione
Smiles: Fc1ccc(cc1)C1=C2C(=O)C(=O)N(C32C(O1)(O)c1ccccc1C3(O)O)Cc1ccccc1

STK681158
Synonyms: methyl2- ({[4- phenyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}sulfamoyl)benzoate
Smiles: COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1nc(cc(n1)C(F)(F)F)c1ccccc1

STK681159
Synonyms: 3- butyl- 2- (5- chloro- 2- methoxyphenyl)- 2,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: CCCCc1c2C(=O)CCCc2nn1c1cc(Cl)ccc1OC

STK681162
Synonyms: 3- {[2- (5- methoxy- 2- methyl- 1H- indol- 3- yl)ethyl]amino}- 2- pentanoylcyclohex- 2- en- 1- one
Smiles: CCCCC(=O)C1=C(CCCC1=O)NCCc1c(C)[nH]c2c1cc(OC)cc2

STK681166
Synonyms: 3- ({2- [5- (benzyloxy)- 2- methyl- 1H- indol- 3- yl]ethyl}amino)- 2- pentanoyl- 5- phenylcyclohex- 2- en- 1- one
Smiles: CCCCC(=O)C1=C(NCCc2c(C)[nH]c3c2cc(OCc2ccccc2)cc3)CC(CC1=O)c1ccccc1

STK681173
Synonyms: 2- {[(4- fluorophenyl)sulfonyl]amino}- 4,5- dimethoxybenzoicacid
Smiles: COc1cc(NS(=O)(=O)c2ccc(cc2)F)c(cc1OC)C(=O)O

STK681175
Synonyms: ethyl{4- [(tetrahydrofuran- 2- ylmethyl)carbamoyl]phenyl}carbamate
Smiles: CCOC(=O)Nc1ccc(cc1)C(=O)NCC1CCCO1

STK772235
Synonyms: (3,5- dimethyl- 1H- pyrazol- 1- yl)[1- (phenylsulfonyl)pyrrolidin- 2- yl]methanone
Smiles: Cc1nn(c(c1)C)C(=O)C1CCCN1S(=O)(=O)c1ccccc1

STK681177
Synonyms: 2,2'- [(2,5- dimethylfuran- 3,4- diyl)bis(carbonyliminobenzene- 4,1- diyl)]diaceticacid
Smiles: O=C(c1c(C)oc(c1C(=O)Nc1ccc(cc1)CC(=O)O)C)Nc1ccc(cc1)CC(=O)O

STK681178
Synonyms: 3- (4- chlorophenyl)- 2- (5- ethyl- 1,3,4- thiadiazol- 2- yl)- 3- hydroxy- 2,3- dihydro- 1H- isoindol- 1- one
Smiles: CCc1nnc(s1)N1C(=O)c2c(C1(O)c1ccc(cc1)Cl)cccc2

STK772238
Synonyms: (1S,2S,5R)- 2- (5- methyl- 1H- tetrazol- 1- yl)- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nnnc1C

STK772239
Synonyms: (1S,2S,5R)- 2- [5- (2- fluorophenyl)- 1H- tetrazol- 1- yl]- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nnnc1c1ccccc1F

STK681180
Synonyms: {5- [(2- oxo- 2- {[4- (trifluoromethoxy)phenyl]amino}ethyl)sulfanyl]- 1H- tetrazol- 1- yl}aceticacid
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CSc1nnnn1CC(=O)O

STK772240
Synonyms: (1S,2S,5R)- 2- (4- tert- butyl- 5- thioxo- 4,5- dihydro- 1H- tetrazol- 1- yl)- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: CC(n1nnn(c1=S)[C@H]1CC(=O)[C@H]2O[C@@H]1CO2)(C)C

STK681181
Synonyms: 2- [(4- bromobenzyl)sulfonyl]- 3H- imidazo[4,5- b]pyridine
Smiles: Brc1ccc(cc1)CS(=O)(=O)c1nc2c([nH]1)nccc2

STK772246
Synonyms: 1- (3- bromobenzyl)- 3- nitropyridin- 2(1H)- one
Smiles: Brc1cccc(c1)Cn1cccc(c1=O)[N+](=O)[O-]

STK772248
Synonyms: ethyl{[1- (4- chloro- 2,5- dimethoxyphenyl)- 1H- tetrazol- 5- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnnn1c1cc(OC)c(cc1OC)Cl

STK772249
Synonyms: 2- (4- bromo- 1H- pyrazol- 1- yl)- 4,6- di(morpholin- 4- yl)- 1,3,5- triazine
Smiles: Brc1cnn(c1)c1nc(nc(n1)N1CCOCC1)N1CCOCC1

STK772251
Synonyms: 2- {[1- (4- chloro- 2,5- dimethoxyphenyl)- 1H- tetrazol- 5- yl]sulfanyl}- N- (3,4- difluorophenyl)acetamide
Smiles: COc1cc(Cl)c(cc1n1nnnc1SCC(=O)Nc1ccc(c(c1)F)F)OC

STK772255
Synonyms: 1- (5- chloro- 2- methoxyphenyl)- 3- ethyl- 1,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: CCc1nn(c2c1C(=O)CCC2)c1cc(Cl)ccc1OC

STK681188
Synonyms: 2- (5- chloro- 2- methoxyphenyl)- 3- ethyl- 2,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: CCc1c2C(=O)CCCc2nn1c1cc(Cl)ccc1OC

STK681190
Synonyms: 2- (1- {[2- (3,4- diethoxyphenyl)ethyl]amino}propylidene)- 5- phenylcyclohexane- 1,3- dione
Smiles: CCOc1cc(CCN/C(=C\2/C(=O)CC(CC2=O)c2ccccc2)/CC)ccc1OCC

STK772256
Synonyms: 2- (5- chloro- 2- methoxyphenyl)- 3- ethyl- 6- phenyl- 2,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: CCc1c2C(=O)CC(Cc2nn1c1cc(Cl)ccc1OC)c1ccccc1

STK681196
Synonyms: 2- (1- {[2- (3,4- diethoxyphenyl)ethyl]amino}butylidene)- 5,5- dimethylcyclohexane- 1,3- dione
Smiles: CCCC(=C1C(=O)CC(CC1=O)(C)C)NCCc1ccc(c(c1)OCC)OCC

STK772257
Synonyms: 1- (5- chloro- 2- methoxyphenyl)- 6,6- dimethyl- 3- propyl- 1,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: CCCc1nn(c2c1C(=O)CC(C2)(C)C)c1cc(Cl)ccc1OC

STK772258
Synonyms: 2- (5- chloro- 2- methoxyphenyl)- 6,6- dimethyl- 3- propyl- 2,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: CCCc1c2C(=O)CC(Cc2nn1c1cc(Cl)ccc1OC)(C)C

STK681199
Synonyms: 1- (5- chloro- 2- methoxyphenyl)- 3- propyl- 1,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: CCCc1nn(c2c1C(=O)CCC2)c1cc(Cl)ccc1OC

STK681203
Synonyms: 2- (1- {[2- (3,4- diethoxyphenyl)ethyl]amino}butylidene)- 5- phenylcyclohexane- 1,3- dione
Smiles: CCC/C(=C\1/C(=O)CC(CC1=O)c1ccccc1)/NCCc1ccc(c(c1)OCC)OCC

STK772264
Synonyms: 3- butyl- 1- (2- fluorophenyl)- 6,6- dimethyl- 1,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: CCCCc1nn(c2c1C(=O)CC(C2)(C)C)c1ccccc1F

STK772265
Synonyms: 3- butyl- 1- (5- chloro- 2- methoxyphenyl)- 1,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: CCCCc1nn(c2c1C(=O)CCC2)c1cc(Cl)ccc1OC

STK681208
Synonyms: 2- [1- ({2- [5- (benzyloxy)- 2- methyl- 1H- indol- 3- yl]ethyl}amino)pentylidene]- 5- phenylcyclohexane- 1,3- dione
Smiles: CCCC/C(=C/1\C(=O)CC(CC1=O)c1ccccc1)/NCCc1c(C)[nH]c2c1cc(OCc1ccccc1)cc2

STK681209
Synonyms: 2- (1- {[2- (3,4- diethoxyphenyl)ethyl]amino}pentylidene)- 5- phenylcyclohexane- 1,3- dione
Smiles: CCCC/C(=C\1/C(=O)CC(CC1=O)c1ccccc1)/NCCc1ccc(c(c1)OCC)OCC

STK681211
Synonyms: 3- {[2- (3,4- diethoxyphenyl)ethyl]amino}- 5,5- dimethyl- 2- propanoylcyclohex- 2- en- 1- one
Smiles: CCOc1cc(CCNC2=C(C(=O)CC)C(=O)CC(C2)(C)C)ccc1OCC

STK681212
Synonyms: 3- {[2- (2,5- dimethyl- 1H- indol- 3- yl)ethyl]amino}- 2- propanoylcyclohex- 2- en- 1- one
Smiles: CCC(=O)C1=C(CCCC1=O)NCCc1c(C)[nH]c2c1cc(C)cc2

STK681213
Synonyms: 3- {[2- (3,4- diethoxyphenyl)ethyl]amino}- 2- propanoylcyclohex- 2- en- 1- one
Smiles: CCOc1cc(CCNC2=C(C(=O)CC)C(=O)CCC2)ccc1OCC

STK681215
Synonyms: 3- ({2- [5- (benzyloxy)- 2- methyl- 1H- indol- 3- yl]ethyl}amino)- 5- phenyl- 2- propanoylcyclohex- 2- en- 1- one
Smiles: CCC(=O)C1=C(NCCc2c(C)[nH]c3c2cc(OCc2ccccc2)cc3)CC(CC1=O)c1ccccc1

STK681217
Synonyms: 3- {[2- (3,4- diethoxyphenyl)ethyl]amino}- 5- phenyl- 2- propanoylcyclohex- 2- en- 1- one
Smiles: CCOc1cc(CCNC2=C(C(=O)CC)C(=O)CC(C2)c2ccccc2)ccc1OCC

STK681218
Synonyms: N- [2- ({[4- (trifluoromethyl)phenyl]carbonyl}amino)phenyl]furan- 2- carboxamide
Smiles: O=C(c1ccc(cc1)C(F)(F)F)Nc1ccccc1NC(=O)c1ccco1

STK681219
Synonyms: 2- butanoyl- 3- {[2- (5- methoxy- 2- methyl- 1H- indol- 3- yl)ethyl]amino}cyclohex- 2- en- 1- one
Smiles: CCCC(=O)C1=C(CCCC1=O)NCCc1c(C)[nH]c2c1cc(OC)cc2

STK681223
Synonyms: 3- ({2- [5- (benzyloxy)- 2- methyl- 1H- indol- 3- yl]ethyl}amino)- 2- butanoyl- 5- phenylcyclohex- 2- en- 1- one
Smiles: CCCC(=O)C1=C(NCCc2c(C)[nH]c3c2cc(OCc2ccccc2)cc3)CC(CC1=O)c1ccccc1

STK772274
Synonyms: 7,7- dimethyl- 1- phenyl- 4- (thiophen- 2- yl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CC(c2cccs2)C2=C(N1c1ccccc1)CC(CC2=O)(C)C

STK772275
Synonyms: 1- (4- methylphenyl)- 4- (thiophen- 2- yl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)CC(C2=C1CCCC2=O)c1cccs1

STK681226
Synonyms: 1- (4- fluorophenyl)- 4- phenyl- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)CC(C2=C1CCCC2=O)c1ccccc1

STK772278
Synonyms: 1- (4- fluorophenyl)- 7,7- dimethyl- 4- (thiophen- 2- yl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cccs1

STK681229
Synonyms: 1- (4- bromo- 2- fluorophenyl)- 4- (thiophen- 2- yl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Brc1ccc(c(c1)F)N1C(=O)CC(C2=C1CCCC2=O)c1cccs1

STK681230
Synonyms: 7,7- dimethyl- 4- (thiophen- 2- yl)- 1- [3- (trifluoromethyl)phenyl]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CC(c2cccs2)C2=C(N1c1cccc(c1)C(F)(F)F)CC(CC2=O)(C)C

STK772279
Synonyms: N- [(prop- 2- yn- 1- yloxy)methyl]morpholine- 4- carbothioamide
Smiles: C#CCOCNC(=S)N1CCOCC1

STK772280
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (4- bromophenyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccc(cc1)Br)c1nonc1N

STK772281
Synonyms: 2- {[6- amino- 4- oxo- 1- (2- phenylethyl)- 1,4- dihydropyrimidin- 2- yl]sulfanyl}- N- (naphthalen- 2- yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)cccc2)CSc1nc(=O)cc(n1CCc1ccccc1)N

STK772282
Synonyms: 2- {[6- amino- 4- oxo- 1- (2- phenylethyl)- 1,4- dihydropyrimidin- 2- yl]sulfanyl}- N- (2- chlorophenyl)acetamide
Smiles: O=C(Nc1ccccc1Cl)CSc1nc(=O)cc(n1CCc1ccccc1)N

STK772284
Synonyms: 2- {[6- amino- 4- oxo- 1- (2- phenylethyl)- 1,4- dihydropyrimidin- 2- yl]sulfanyl}- N- (5- methyl- 1,2- oxazol- 3- yl)acetamide
Smiles: O=C(Nc1noc(c1)C)CSc1nc(=O)cc(n1CCc1ccccc1)N

STK772291
Synonyms: 1- (4- fluorophenyl)- 7,7- dimethyl- 4- (thiophen- 3- yl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cscc1

STK772293
Synonyms: 1H- benzimidazol- 2- ylmethylN- (phenylcarbonyl)methioninate
Smiles: CSCCC(C(=O)OCc1nc2c([nH]1)cccc2)NC(=O)c1ccccc1

STK772294
Synonyms: 2,4- dichlorobenzyl5- amino- 2- phenyl- 2H- 1,2,3- triazole- 4- carboxylate
Smiles: Clc1ccc(c(c1)Cl)COC(=O)c1nn(nc1N)c1ccccc1

STK772300
Synonyms: 4- [1- (pyridin- 2- ylmethyl)- 1H- benzimidazol- 2- yl]- 1,2,5- oxadiazol- 3- amine
Smiles: Nc1nonc1c1nc2c(n1Cc1ccccn1)cccc2

STK681234
Synonyms: 1- [6- (1H- pyrrol- 1- yl)- 1,3- benzodioxol- 5- yl]methanamine
Smiles: NCc1cc2OCOc2cc1n1cccc1

STK681235
Synonyms: 2- (8,9- diethoxy- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepin- 4- yl)- 6- ethoxyphenol
Smiles: CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1cccc(c1O)OCC

STK681237
Synonyms: 2- (1- {[2- (3,4- diethoxyphenyl)ethyl]amino}ethylidene)cyclohexane- 1,3- dione
Smiles: CCOc1cc(CCNC(=C2C(=O)CCCC2=O)C)ccc1OCC

STK681239
Synonyms: 2- (1- {[2- (3,4- diethoxyphenyl)ethyl]amino}ethylidene)- 5- phenylcyclohexane- 1,3- dione
Smiles: CCOc1cc(CCN/C(=C\2/C(=O)CC(CC2=O)c2ccccc2)/C)ccc1OCC

STK681240
Synonyms: 2- (1- {[2- (3,4- diethoxyphenyl)ethyl]amino}propylidene)cyclohexane- 1,3- dione
Smiles: CCOc1cc(CCNC(=C2C(=O)CCCC2=O)CC)ccc1OCC

STK681249
Synonyms: 2- (1- {[2- (3,4- diethoxyphenyl)ethyl]amino}pentylidene)- 5,5- dimethylcyclohexane- 1,3- dione
Smiles: CCCCC(=C1C(=O)CC(CC1=O)(C)C)NCCc1ccc(c(c1)OCC)OCC

STK681252
Synonyms: 3- ({2- [5- (benzyloxy)- 2- methyl- 1H- indol- 3- yl]ethyl}amino)- 5,5- dimethyl- 2- propanoylcyclohex- 2- en- 1- one
Smiles: CCC(=O)C1=C(NCCc2c(C)[nH]c3c2cc(OCc2ccccc2)cc3)CC(CC1=O)(C)C

STK681254
Synonyms: 3- ({2- [5- (benzyloxy)- 2- methyl- 1H- indol- 3- yl]ethyl}amino)- 2- propanoylcyclohex- 2- en- 1- one
Smiles: CCC(=O)C1=C(CCCC1=O)NCCc1c(C)[nH]c2c1cc(OCc1ccccc1)cc2

STK681260
Synonyms: 2- butanoyl- 3- {[2- (3,4- diethoxyphenyl)ethyl]amino}- 5,5- dimethylcyclohex- 2- en- 1- one
Smiles: CCCC(=O)C1=C(NCCc2ccc(c(c2)OCC)OCC)CC(CC1=O)(C)C

STK681263
Synonyms: 2- butanoyl- 3- {[2- (3,4- diethoxyphenyl)ethyl]amino}- 5- phenylcyclohex- 2- en- 1- one
Smiles: CCCC(=O)C1=C(NCCc2ccc(c(c2)OCC)OCC)CC(CC1=O)c1ccccc1

STK681268
Synonyms: 3- {[2- (3,4- diethoxyphenyl)ethyl]amino}- 5,5- dimethyl- 2- pentanoylcyclohex- 2- en- 1- one
Smiles: CCCCC(=O)C1=C(NCCc2ccc(c(c2)OCC)OCC)CC(CC1=O)(C)C

STK772315
Synonyms: N- (2- cyano- 4,5- diethoxyphenyl)- 3- nitrobenzamide
Smiles: CCOc1cc(NC(=O)c2cccc(c2)[N+](=O)[O-])c(cc1OCC)C#N

STK772316
Synonyms: 2- (4- chlorophenoxy)- N- (2- cyano- 4,5- diethoxyphenyl)acetamide
Smiles: CCOc1cc(NC(=O)COc2ccc(cc2)Cl)c(cc1OCC)C#N

STK772318
Synonyms: 2- (4- chloro- 2- methylphenoxy)- N- (2- cyano- 4,5- diethoxyphenyl)acetamide
Smiles: CCOc1cc(NC(=O)COc2ccc(cc2C)Cl)c(cc1OCC)C#N

STK681271
Synonyms: 2,2'- (piperazine- 1,4- diyldimethanediyl)bis[4- methyl- 6- (1- methylcyclohexyl)phenol]
Smiles: Cc1cc(CN2CCN(CC2)Cc2cc(C)cc(c2O)C2(C)CCCCC2)c(c(c1)C1(C)CCCCC1)O

STK681283
Synonyms: (5Z)- 5- {[2- (dimethylamino)pyrimidin- 5- yl]methylidene}- 1- (3- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1cccc(c1)N1C(=O)NC(=O)/C(=C/c2cnc(nc2)N(C)C)/C1=O

STK681289
Synonyms: 2- {[5- (4- bromophenyl)- 4- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc(n1c1cccc(c1)C)c1ccc(cc1)Br

STK681292
Synonyms: N- (2,5- dimethylphenyl)- 2- {[5- (phenylamino)- 1,3,4- thiadiazol- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(s1)Nc1ccccc1

STK681309
Synonyms: 2- {[5- (1H- benzotriazol- 1- ylmethyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,6- dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1c1ccccc1)Cn1nnc2c1cccc2

STK681311
Synonyms: N- (3- methylphenyl)- 2- ({4- (3- methylphenyl)- 5- [(phenylsulfanyl)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: Cc1cccc(c1)n1c(SCC(=O)Nc2cccc(c2)C)nnc1CSc1ccccc1

STK681312
Synonyms: N- (2- methylphenyl)- 2- ({4- (3- methylphenyl)- 5- [(phenylsulfanyl)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nnc(n1c1cccc(c1)C)CSc1ccccc1

STK681315
Synonyms: 2- [(5- {[(3- chlorophenyl)amino]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- 1- phenylethanone
Smiles: Clc1cccc(c1)NCc1nnc(n1c1ccccc1)SCC(=O)c1ccccc1

STK681316
Synonyms: 2- [(5- {[(3- chloro- 2- methylphenyl)amino]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- 1- phenylethanone
Smiles: O=C(c1ccccc1)CSc1nnc(n1c1ccccc1)CNc1cccc(c1C)Cl

STK681319
Synonyms: N- (3- methoxyphenyl)- 2- ({4- (3- methylphenyl)- 5- [(phenylsulfanyl)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1c1cccc(c1)C)CSc1ccccc1

STK772339
Synonyms: 5'- benzyl- 3'- methyl- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CC1NC2(C3C1C(=O)N(C3=O)Cc1ccccc1)C(=O)Nc1c2cccc1

STK772342
Synonyms: 1- [(3- hydroxypropyl)amino]anthracene- 9,10- dione
Smiles: OCCCNc1cccc2c1C(=O)c1ccccc1C2=O

STK681327
Synonyms: 6- bromo- 5- methoxy- 3,3- dimethyl- 1- (methylsulfanyl)- 3,4- dihydroisoquinoline
Smiles: CSC1=NC(C)(C)Cc2c1ccc(c2OC)Br

STK681350
Synonyms: 11- (3- bromo- 4- methoxyphenyl)- 3- (4- ethoxy- 3- methoxyphenyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: CCOc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccc(c(c1)Br)OC

STK772346
Synonyms: 3- (trifluoromethyl)[1,2,4]triazolo[4,3- b]pyridazin- 6- amine
Smiles: Nc1ccc2n(n1)c(nn2)C(F)(F)F

STK772347
Synonyms: tetrazolo[1,5- b]pyridazin- 6- amine
Smiles: Nc1ccc2n(n1)nnn2

STK681361
Synonyms: 6- (1H- imidazol- 1- yl)- 3- (trifluoromethyl)[1,2,4]triazolo[3,4- a]phthalazine
Smiles: FC(c1nnc2n1nc(n1cncc1)c1c2cccc1)(F)F

STK681365
Synonyms: (2Z)- 3- (4- chlorophenyl)- 2- (3,4- dimethoxyphenyl)prop- 2- enoicacid
Smiles: COc1cc(ccc1OC)/C(=C/c1ccc(cc1)Cl)/C(=O)O

STK681367
Synonyms: (2Z)- 2- (3,4- dimethoxyphenyl)- 3- (4- methoxyphenyl)prop- 2- enoicacid
Smiles: COc1ccc(cc1)/C=C(/c1ccc(c(c1)OC)OC)\C(=O)O

STK681371
Synonyms: ethyl2- [({[5- (4- methoxybenzyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}acetyl)amino]- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(o2)Cc2ccc(cc2)OC)sc2c1CCC2

STK681376
Synonyms: N- benzyl- 2- {[4- benzyl- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(CSc1nnc(n1Cc1ccccc1)COc1ccccc1)NCc1ccccc1

STK681378
Synonyms: ethyl2- {[({5- [(4- methoxyphenoxy)methyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)acetyl]amino}- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(o2)COc2ccc(cc2)OC)sc2c1CCC2

STK681379
Synonyms: 2- ({4- benzyl- 5- [(4- bromophenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4- dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc(n1Cc1ccccc1)COc1ccc(cc1)Br

STK772355
Synonyms: 1- methyl- 4- phenyl- 1,4- dihydro- 5H- tetrazol- 5- one
Smiles: O=c1n(C)nnn1c1ccccc1

STK772358
Synonyms: 2- {[4- benzyl- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (difluoromethoxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OC(F)F)CSc1nnc(n1Cc1ccccc1)COc1ccccc1

STK681423
Synonyms: octyl[(3- cyano- 4,6- diphenylpyridin- 2- yl)sulfanyl]acetate
Smiles: CCCCCCCCOC(=O)CSc1nc(cc(c1C#N)c1ccccc1)c1ccccc1

STK681431
Synonyms: methyl5- (4- chlorophenyl)- 6- (phenylcarbonyl)- 4,5- dihydrotetrazolo[1,5- a]pyrimidine- 7- carboxylate
Smiles: COC(=O)C1=C(C(Nc2n1nnn2)c1ccc(cc1)Cl)C(=O)c1ccccc1

STK772378
Synonyms: ethyl4- ({[(4- amino- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]acetyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nc(N)cc(=O)[nH]1

STK772391
Synonyms: 8- ethyl- 2- {4- [(4- methylphenyl)carbamothioyl]piperazin- 1- yl}- 5- oxo- 5,8- dihydropyrido[2,3- d]pyrimidine- 6- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1nc(nc2)N1CCN(CC1)C(=S)Nc1ccc(cc1)C

STK772393
Synonyms: 8- ethyl- 2- (4- {[(2- methylphenyl)carbonyl]carbamothioyl}piperazin- 1- yl)- 5- oxo- 5,8- dihydropyrido[2,3- d]pyrimidine- 6- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1nc(nc2)N1CCN(CC1)C(=S)NC(=O)c1ccccc1C

STK772396
Synonyms: 8- ethyl- 5- oxo- 2- {4- [(tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)carbamothioyl]piperazin- 1- yl}- 5,8- dihydropyrido[2,3- d]pyrimidine- 6- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1nc(nc2)N1CCN(CC1)C(=S)NC(=O)C12CC3CC(C2)CC(C1)C3

STK772403
Synonyms: 3- hydrazinylquinoxalin- 2(1H)- one
Smiles: NNc1nc2ccccc2[nH]c1=O

STK681469
Synonyms: 3- (benzylamino)- 2- [(2E)- 3- (3,4- dimethoxyphenyl)prop- 2- enoyl]- 5,5- dimethylcyclohex- 2- en- 1- one
Smiles: COc1ccc(cc1OC)/C=C/C(=O)C1=C(NCc2ccccc2)CC(CC1=O)(C)C

STK772406
Synonyms: ethyl{2- [(6,7- dimethoxyisoquinolin- 1- yl)methyl]- 4,5- dimethoxyphenyl}carbamate
Smiles: CCOC(=O)Nc1cc(OC)c(cc1Cc1nccc2c1cc(OC)c(c2)OC)OC

STK681474
Synonyms: 2- [(1- phenylprop- 2- en- 1- yl)oxy]benzaldehyde
Smiles: C=CC(c1ccccc1)Oc1ccccc1C=O

STK681481
Synonyms: 4- chloro- 2- formylphenyl(2E)- 3- (4- fluorophenyl)prop- 2- enoate
Smiles: O=Cc1cc(Cl)ccc1OC(=O)/C=C/c1ccc(cc1)F

STK681488
Synonyms: 2- oxo- 2- phenylethyl2- {[(4- methoxyphenoxy)acetyl]amino}benzoate
Smiles: COc1ccc(cc1)OCC(=O)Nc1ccccc1C(=O)OCC(=O)c1ccccc1

STK772416
Synonyms: 2,4- dichloro- N- [2- (4,4- dimethyl- 2,6- dioxocyclohexyl)- 1,1,1,3,3,3- hexafluoropropan- 2- yl]benzamide
Smiles: O=C1CC(C)(C)CC(=O)C1C(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccc(cc1Cl)Cl

STK681491
Synonyms: 7- [(2- aminoethyl)amino]- 3- methyl- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: NCCNc1cc2oc3cc(C)ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1

STK681493
Synonyms: 1- (4- chlorophenyl)- 2- [(5- {[(4- chlorophenyl)amino]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]ethanone
Smiles: Clc1ccc(cc1)NCc1nnc(n1c1ccccc1)SCC(=O)c1ccc(cc1)Cl

STK681494
Synonyms: 2- [(5- {[(4- chlorophenyl)amino]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- 1- phenylethanone
Smiles: Clc1ccc(cc1)NCc1nnc(n1c1ccccc1)SCC(=O)c1ccccc1

STK681495
Synonyms: 2- [(5- {[(4- chlorophenyl)amino]methyl}- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1c1ccccc1)CNc1ccc(cc1)Cl

STK681547
Synonyms: 3- tert- butyl- 7- (phenylamino)- 4H- [1,3,4]thiadiazolo[2,3- c][1,2,4]triazin- 4- one
Smiles: CC(c1nnc2n(c1=O)nc(s2)Nc1ccccc1)(C)C

STK681552
Synonyms: N- [(2Z)- 4- (4- chlorophenyl)- 3- (4- methylpiperazin- 1- yl)- 1,3- thiazol- 2(3H)- ylidene]- 2,3- dimethylaniline
Smiles: CN1CCN(CC1)n1/c(=N/c2cccc(c2C)C)/scc1c1ccc(cc1)Cl

STK681555
Synonyms: 2- [(2Z)- 2- [(2,5- dimethylphenyl)imino]- 4- (4- methoxyphenyl)- 1,3- thiazol- 3(2H)- yl]ethanol
Smiles: OCCn1/c(=N/c2cc(C)ccc2C)/scc1c1ccc(cc1)OC

STK772426
Synonyms: 3- tert- butyl- 7- {[2- (3- nitrophenyl)- 2- oxoethyl]sulfanyl}- 4H- [1,3,4]thiadiazolo[2,3- c][1,2,4]triazin- 4- one
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CSc1nn2c(s1)nnc(c2=O)C(C)(C)C

STK681556
Synonyms: methyl4- [({[(4E)- 4- (4- methoxybenzylidene)- 1- (4- methoxyphenyl)- 5- oxo- 4,5- dihydro- 1H- imidazol- 2- yl]sulfanyl}acetyl)amino]benzoate
Smiles: COc1ccc(cc1)N1C(=N/C(=C/c2ccc(cc2)OC)/C1=O)SCC(=O)Nc1ccc(cc1)C(=O)OC

STK681574
Synonyms: ethyl1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 5- hydroxy- 2- methyl- 1H- benzo[g]indole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(O)c1c2cccc1)CCC1=CCCCC1

STK681587
Synonyms: 7- [2- (2- fluoro- 4- methoxyphenyl)- 2- oxoethyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(c(c1)F)C(=O)Cn1cnc2c1c(=O)[nH]c(=O)n2C

STK681608
Synonyms: 4- acetyl- 1- (2- fluorophenyl)- 3- hydroxy- 5- (3- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccccc1F

STK772479
Synonyms: N- (diphenylmethyl)- N~2~- (4- methylphenyl)- N~2~- (pyrrolidin- 1- ylsulfonyl)glycinamide
Smiles: O=C(CN(S(=O)(=O)N1CCCC1)c1ccc(cc1)C)NC(c1ccccc1)c1ccccc1

STK681626
Synonyms: N- (4- ethylphenyl)- 2- {[1- (4- hydroxyphenyl)- 1H- tetrazol- 5- yl]sulfanyl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnnn1c1ccc(cc1)O

STK772482
Synonyms: 3- [(2- fluorobenzyl)sulfanyl]- 5- (2- methoxyphenyl)- 1H- 1,2,4- triazole
Smiles: COc1ccccc1c1[nH]nc(n1)SCc1ccccc1F

STK772485
Synonyms: 2- methyl- N- [2- (morpholin- 4- yl)ethyl]benzo[h]quinolin- 4- amine
Smiles: Cc1cc(NCCN2CCOCC2)c2c(n1)c1ccccc1cc2

STK772486
Synonyms: N- [1,3- dimethyl- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]acetamide
Smiles: CC(=O)NC1(C(=O)Nc2c1c(=O)n(c(=O)n2C)C)C(F)(F)F

STK681632
Synonyms: 5- ethyl- 6- methyl- 2- sulfanylpyrimidin- 4(3H)- one
Smiles: Cc1nc(S)[nH]c(=O)c1CC

STK681633
Synonyms: dihexadecylbiphenyl- 4,4'- dicarboxylate
Smiles: CCCCCCCCCCCCCCCCOC(=O)c1ccc(cc1)c1ccc(cc1)C(=O)OCCCCCCCCCCCCCCCC

STK681634
Synonyms: dipentadecylbiphenyl- 4,4'- dicarboxylate
Smiles: CCCCCCCCCCCCCCCOC(=O)c1ccc(cc1)c1ccc(cc1)C(=O)OCCCCCCCCCCCCCCC

STK681635
Synonyms: (5E)- N- (4- bromophenyl)- 5- {1- [(4- bromophenyl)amino]ethylidene}- 2,2- dimethyl- 4,6- dioxocyclohexanecarboxamide
Smiles: Brc1ccc(cc1)N/C(=C/1\C(=O)CC(C(C1=O)C(=O)Nc1ccc(cc1)Br)(C)C)/C

STK772490
Synonyms: dipropyl2,6- diamino- 4- (4- chlorophenyl)benzo[1,2- b:4,5- b']difuran- 3,7- dicarboxylate
Smiles: CCCOC(=O)c1c(N)oc2c1cc1oc(c(c1c2c1ccc(cc1)Cl)C(=O)OCCC)N

STK681647
Synonyms: dipropyl4- [4- (acetylamino)phenyl]- 2,6- diaminobenzo[1,2- b:4,5- b']difuran- 3,7- dicarboxylate
Smiles: CCCOC(=O)c1c(N)oc2c1cc1oc(c(c1c2c1ccc(cc1)NC(=O)C)C(=O)OCCC)N

STK681648
Synonyms: dipropyl2,6- diamino- 4- phenylbenzo[1,2- b:4,5- b']difuran- 3,7- dicarboxylate
Smiles: CCCOC(=O)c1c(N)oc2c1cc1oc(c(c1c2c1ccccc1)C(=O)OCCC)N

STK681669
Synonyms: (4- bromophenyl)[4- hydroxy- 3- (phenylcarbonyl)- 1H- pyrazol- 5- yl]methanone
Smiles: Brc1ccc(cc1)C(=O)c1[nH]nc(c1O)C(=O)c1ccccc1

STK681670
Synonyms: [6- (4- bromophenyl)- 4- hydroxypyridazin- 3- yl](phenyl)methanone
Smiles: Brc1ccc(cc1)c1nnc(c(c1)O)C(=O)c1ccccc1

STK681671
Synonyms: (4- hydroxy- 6- phenylpyridazin- 3- yl)(phenyl)methanone
Smiles: Oc1cc(nnc1C(=O)c1ccccc1)c1ccccc1

STK772498
Synonyms: 2- [(5- methyl- 4- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N- [1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethyl]acetamide
Smiles: O=C(NC(C12CC3CC(C2)CC(C1)C3)C)CSc1nnc(n1c1ccccc1)C

STK772504
Synonyms: 3- (1,3- benzodioxol- 5- ylamino)- 6- methyl- 1,2,4- triazin- 5(2H)- one
Smiles: O=c1nc([nH]nc1C)Nc1ccc2c(c1)OCO2

STK772505
Synonyms: N- [1- benzyl- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]- 2- chloroacetamide
Smiles: ClCC(=O)NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2Cc1ccccc1)C(F)(F)F

STK681696
Synonyms: N- [2- (benzylamino)- 1,1,1,3,3,3- hexafluoropropan- 2- yl]- 2- iodobenzamide
Smiles: Ic1ccccc1C(=O)NC(C(F)(F)F)(C(F)(F)F)NCc1ccccc1

STK681699
Synonyms: 12H- benzo[f]indeno[1,2- b]quinolin- 12- one
Smiles: O=C1c2cc3c(nc2c2c1cccc2)ccc1c3cccc1

STK772507
Synonyms: N- (4- bromophenyl)- 2- [(2E)- 4- oxo- 3- (prop- 2- en- 1- yl)- 2- (1,3- thiazol- 2- ylimino)- 1,3- thiazolidin- 5- yl]acetamide
Smiles: C=CCN1/C(=N\c2nccs2)/SC(C1=O)CC(=O)Nc1ccc(cc1)Br

STK681706
Synonyms: N- (4- chlorophenyl)- 4- [5- (2,5- dichlorophenyl)furan- 2- yl]- 1,3- thiazol- 2- amine
Smiles: Clc1ccc(cc1)Nc1scc(n1)c1ccc(o1)c1cc(Cl)ccc1Cl

STK681707
Synonyms: N- (4- bromophenyl)- 4- [5- (2- chloro- 4- nitrophenyl)furan- 2- yl]- 1,3- thiazol- 2- amine
Smiles: Brc1ccc(cc1)Nc1scc(n1)c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-]

STK681714
Synonyms: N- [1- (4- methylphenyl)- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]benzenesulfonamide
Smiles: Cc1ccc(cc1)n1c(=O)[nH]c(=O)c2c1NC(=O)C2(NS(=O)(=O)c1ccccc1)C(F)(F)F

STK772513
Synonyms: (3Z)- 3- (1H- indol- 3- ylmethylidene)- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1Nc2c(/C/1=C/c1c[nH]c3c1cccc3)cccc2

STK772514
Synonyms: ethyl2- oxo- 5- (piperidin- 1- ylsulfonyl)- 1,3- benzoxazole- 3(2H)- carboxylate
Smiles: CCOC(=O)n1c(=O)oc2c1cc(cc2)S(=O)(=O)N1CCCCC1

STK772515
Synonyms: butyl2- oxo- 5- (piperidin- 1- ylsulfonyl)- 1,3- benzoxazole- 3(2H)- carboxylate
Smiles: CCCCOC(=O)n1c(=O)oc2c1cc(cc2)S(=O)(=O)N1CCCCC1

STK772516
Synonyms: phenyl6- [(4- methylphenyl)sulfamoyl]- 2- oxo- 1,3- benzoxazole- 3(2H)- carboxylate
Smiles: Cc1ccc(cc1)NS(=O)(=O)c1ccc2c(c1)oc(=O)n2C(=O)Oc1ccccc1

STK681721
Synonyms: 2- methylpropyl6- [(4- methylphenyl)sulfamoyl]- 2- oxo- 1,3- benzoxazole- 3(2H)- carboxylate
Smiles: CC(COC(=O)n1c(=O)oc2c1ccc(c2)S(=O)(=O)Nc1ccc(cc1)C)C

STK772519
Synonyms: 2- methoxy- 4- (3,3,6,6- tetramethyl- 1,8- dioxo- 2,3,4,5,6,7,8,9- octahydro- 1H- xanthen- 9- yl)phenylhexanoate
Smiles: CCCCCC(=O)Oc1ccc(cc1OC)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C

STK681729
Synonyms: 13- (4- bromophenyl)- 14- oxadispiro[4.1.5.3]pentadecane- 6,15- dione
Smiles: Brc1ccc(cc1)C1OC(=O)C2(C(=O)C31CCCCC3)CCCC2

STK772524
Synonyms: N- {1,1,1,3,3,3- hexafluoro- 2- [(methylcarbamoyl)amino]propan- 2- yl}cyclohexanecarboxamide
Smiles: CNC(=O)NC(C(F)(F)F)(C(F)(F)F)NC(=O)C1CCCCC1

STK681737
Synonyms: N- {2- [(benzylcarbamoyl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}benzamide
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccccc1)NCc1ccccc1

STK772525
Synonyms: 1,3- dimethyl- 7- (pyridin- 4- yl)- 5,5- bis(trifluoromethyl)- 5,8- dihydropyrimido[4,5- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: O=c1n(C)c2NC(=NC(c2c(=O)n1C)(C(F)(F)F)C(F)(F)F)c1ccncc1

STK772544
Synonyms: 2- oxo- 4- phenyl- 6- (thiophen- 2- yl)- 1,2- dihydropyridine- 3- carbonitrile
Smiles: N#Cc1c(=O)[nH]c(cc1c1ccccc1)c1cccs1

STK681744
Synonyms: 4,8- bis(4- methoxyphenyl)- 6- methyl- 2- (prop- 2- en- 1- ylsulfanyl)- 1,4,4a,5,6,7,7a,8- octahydrochromeno[3,2- i]quinazoline- 11,12- diol
Smiles: C=CCSC1=NC(c2ccc(cc2)OC)C2C3(N1)Oc1c(O)c(O)ccc1C(C3CC(C2)C)c1ccc(cc1)OC

STK772549
Synonyms: (2E)- 3- benzyl- N- (4- chlorophenyl)- 2- [(4- fluorophenyl)imino]- 4- oxo- 1,3- thiazinane- 6- carboxamide
Smiles: Fc1ccc(cc1)/N=C\1/SC(CC(=O)N1Cc1ccccc1)C(=O)Nc1ccc(cc1)Cl

STK772571
Synonyms: 3- methyl- 5- phenyl- 1,2,3,4- tetrahydrobenzo[a]phenanthridine
Smiles: CC1CCc2c(C1)c(nc1c2c2ccccc2cc1)c1ccccc1

STK681780
Synonyms: methyl2- (2- cyano- 2- thiocyanatoethyl)benzoate
Smiles: N#CC(Cc1ccccc1C(=O)OC)SC#N

STK772594
Synonyms: methyl(5- chloro- 2- oxo- 1,3- benzoxazol- 3(2H)- yl)acetate
Smiles: COC(=O)Cn1c(=O)oc2c1cc(Cl)cc2

STK772602
Synonyms: 6,8,8- trimethyl- 2,3,8,9- tetrahydro[1,4]dioxino[2,3- g]isoquinoline
Smiles: CC1=NC(C)(C)Cc2c1cc1OCCOc1c2

STK681788
Synonyms: 8,8- dimethyl- 6- phenyl- 2,3,8,9- tetrahydro[1,4]dioxino[2,3- g]isoquinoline
Smiles: CC1(C)Cc2cc3OCCOc3cc2C(=N1)c1ccccc1

STK772603
Synonyms: 2- hydroxyethyl2- amino- 3- cyano- 6,7- dihydro- 5H- cyclopenta[b]pyridine- 4- carboxylate
Smiles: OCCOC(=O)c1c(C#N)c(N)nc2c1CCC2

STK681791
Synonyms: 4- chloro- 5- (4- nitrophenyl)- 3- (trifluoromethyl)- 1H- pyrazole
Smiles: [O-][N+](=O)c1ccc(cc1)c1[nH]nc(c1Cl)C(F)(F)F

STK681792
Synonyms: 4- bromo- 5- (4- nitrophenyl)- 3- (trifluoromethyl)- 1H- pyrazole
Smiles: [O-][N+](=O)c1ccc(cc1)c1[nH]nc(c1Br)C(F)(F)F

STK681793
Synonyms: 4- chloro- 5- (3- nitrophenyl)- 3- (trifluoromethyl)- 1H- pyrazole
Smiles: [O-][N+](=O)c1cccc(c1)c1[nH]nc(c1Cl)C(F)(F)F

STK681799
Synonyms: N- benzyl- 6- bromo- 1- [(4- bromophenyl)carbonyl]- 1- ethyl- 2- oxo- 1,7b- dihydrocyclopropa[c]chromene- 1a(2H)- carboxamide
Smiles: CCC1(C(=O)c2ccc(cc2)Br)C2C1(C(=O)NCc1ccccc1)C(=O)Oc1c2cc(Br)cc1

STK772608
Synonyms: N'- [(2Z)- 4- oxo- 3- (prop- 2- en- 1- yl)- 1,3- thiazolidin- 2- ylidene]pyridine- 4- carbohydrazide
Smiles: C=CCN1C(=O)CS/C/1=N\NC(=O)c1ccncc1

STK681804
Synonyms: {1- [(2- chlorophenyl)amino]- 2,2,2- trifluoroethylidene}propanedinitrile
Smiles: N#CC(=C(C(F)(F)F)Nc1ccccc1Cl)C#N

STK681806
Synonyms: ethyl1- benzyl- 2- [(4- benzylpiperazin- 1- yl)methyl]- 6- bromo- 5- hydroxy- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c(CN2CCN(CC2)Cc2ccccc2)n(c2c1cc(O)c(c2)Br)Cc1ccccc1

STK772611
Synonyms: 12- (3,4- dihydroxyphenyl)- 8,9,10,12- tetrahydrobenzo[b][4,7]phenanthrolin- 11(7H)- one
Smiles: O=C1CCCC2=C1C(c1ccc(c(c1)O)O)c1c(N2)ccc2c1cccn2

STK681819
Synonyms: 5,7- dibromo- 1,2,3,4- tetrahydroquinolin- 8- ol
Smiles: Brc1cc(Br)c(c2c1CCCN2)O

STK772616
Synonyms: 2- (4- {(E)- [5- oxo- 2- (thiophen- 2- yl)- 1,3- oxazol- 4(5H)- ylidene]methyl}phenoxy)acetamide
Smiles: NC(=O)COc1ccc(cc1)/C=C\1/N=C(OC1=O)c1cccs1

STK772619
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (4- methoxyphenyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccc(cc1)OC)c1nonc1N

STK772620
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (4- cyclohexylphenyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccc(cc1)C1CCCCC1)c1nonc1N

STK681831
Synonyms: 2- (2,4- dihydroxyphenyl)cyclohexane- 1,3- dione
Smiles: O=C1CCCC(=O)C1c1ccc(cc1O)O

STK772622
Synonyms: methyl4- ({[(5- ethyl- 4- hydroxy- 6- methylpyrimidin- 2- yl)sulfanyl]acetyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nc(C)c(c(n1)O)CC

STK772623
Synonyms: N- (2,5- dimethoxyphenyl)- 2- [(5- ethyl- 4- hydroxy- 6- methylpyrimidin- 2- yl)sulfanyl]acetamide
Smiles: COc1ccc(c(c1)NC(=O)CSc1nc(C)c(c(n1)O)CC)OC

STK681847
Synonyms: (5Z)- 5- (2- fluorobenzylidene)- 2- phenyl- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: O=C1NC(=N/C/1=C\c1ccccc1F)c1ccccc1

STK681852
Synonyms: 1- [2- {[(4- methoxyphenyl)carbonyl]amino}- 4- (trifluoromethyl)phenyl]piperidine- 4- carboxamide
Smiles: COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CCC(CC1)C(=O)N)C(F)(F)F

STK681853
Synonyms: 1- [2- {[(4- bromophenyl)carbonyl]amino}- 4- (trifluoromethyl)phenyl]piperidine- 4- carboxamide
Smiles: O=C(c1ccc(cc1)Br)Nc1cc(ccc1N1CCC(CC1)C(=O)N)C(F)(F)F

STK681865
Synonyms: N- (3- chlorophenyl)- 2- (2,3- dichlorophenoxy)acetamide
Smiles: O=C(Nc1cccc(c1)Cl)COc1cccc(c1Cl)Cl

STK681866
Synonyms: 2- (2,3- dichlorophenoxy)- 1- [4- (2- methylphenyl)piperazin- 1- yl]ethanone
Smiles: O=C(N1CCN(CC1)c1ccccc1C)COc1cccc(c1Cl)Cl

STK681874
Synonyms: 3- methylbutyl({[4- (methylsulfanyl)phenyl]sulfonyl}amino)(phenyl)acetate
Smiles: CSc1ccc(cc1)S(=O)(=O)NC(c1ccccc1)C(=O)OCCC(C)C

STK681875
Synonyms: 1,2,5,7- tetramethyl- 3,6- dihydro- 9H- pyrrolo[3,2- f]quinolin- 9- one
Smiles: Cc1cc(=O)c2c([nH]1)c(C)cc1c2c(C)c([nH]1)C

STK772637
Synonyms: (5- amino- 3- methyl- 4- phenyl- 1H- pyrazol- 1- yl)(4- chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)n1nc(c(c1N)c1ccccc1)C

STK681876
Synonyms: 2- {5- [4- (trifluoromethyl)phenyl]- 1,3,4- oxadiazol- 2- yl}phenol
Smiles: Oc1ccccc1c1nnc(o1)c1ccc(cc1)C(F)(F)F

STK772640
Synonyms: trimethyl1- (2- phenylethyl)- 1,4- dihydropyridine- 3,4,5- tricarboxylate
Smiles: COC(=O)C1=CN(CCc2ccccc2)C=C(C1C(=O)OC)C(=O)OC

STK772641
Synonyms: 2- {[3- cyano- 4- (methoxymethyl)- 6- methylpyridin- 2- yl]sulfanyl}- N- {2- [2- methyl- 5- (trifluoromethoxy)- 1H- indol- 3- yl]ethyl}acetamide
Smiles: COCc1cc(C)nc(c1C#N)SCC(=O)NCCc1c(C)[nH]c2c1cc(cc2)OC(F)(F)F

STK772644
Synonyms: N- tert- butyl- 2- [(3- cyano- 4,6- dimethylpyridin- 2- yl)sulfanyl]acetamide
Smiles: N#Cc1c(C)cc(nc1SCC(=O)NC(C)(C)C)C

STK681878
Synonyms: 2- [(1H- benzimidazol- 2- ylmethyl)sulfanyl]- 5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Cc1cc(C)n2c(n1)nc(n2)SCc1nc2c([nH]1)cccc2

STK772647
Synonyms: 2- (butylsulfanyl)- 5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: CCCCSc1nn2c(n1)nc(cc2C)C

STK681880
Synonyms: 4,5,6- trimethyl- 2- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]pyridine- 3- carbonitrile
Smiles: N#Cc1c(Sc2nnnn2c2ccccc2)nc(c(c1C)C)C

STK772652
Synonyms: 2,6- dichloro- N- (diethylcarbamoyl)- 4- methylpyridine- 3- carboxamide
Smiles: CCN(C(=O)NC(=O)c1c(C)cc(nc1Cl)Cl)CC

STK772656
Synonyms: N- (tert- butylcarbamoyl)- 2,6- dichloro- 4- methylpyridine- 3- carboxamide
Smiles: O=C(NC(C)(C)C)NC(=O)c1c(C)cc(nc1Cl)Cl

STK681882
Synonyms: 2- methoxy- 4- (morpholin- 4- yl)- 6- (1H- pyrrol- 1- yl)- 1,3,5- triazine
Smiles: COc1nc(nc(n1)n1cccc1)N1CCOCC1

STK772658
Synonyms: 2- hydrazinyl- 4- methoxy- 6- (morpholin- 4- yl)- 1,3,5- triazine
Smiles: NNc1nc(OC)nc(n1)N1CCOCC1

STK772662
Synonyms: 4- (furan- 2- yl)- 3- methyl- 6- phenyl- 4,5- dihydro- 1H- indazole
Smiles: Cc1n[nH]c2c1C(CC(=C2)c1ccccc1)c1ccco1

STK772666
Synonyms: N'- (acetyloxy)- 4- methoxy- 6- (morpholin- 4- yl)- 1,3,5- triazine- 2- carboximidamide
Smiles: COc1nc(nc(n1)/C(=N\OC(=O)C)/N)N1CCOCC1

STK681887
Synonyms: 2- chloro- 4- methoxy- 6- (pyrrolidin- 1- yl)- 1,3,5- triazine
Smiles: COc1nc(nc(n1)Cl)N1CCCC1

STK681888
Synonyms: N'- hydroxy- 4- methoxy- 6- (pyrrolidin- 1- yl)- 1,3,5- triazine- 2- carboximidamide
Smiles: COc1nc(nc(n1)/C(=N\O)/N)N1CCCC1

STK681889
Synonyms: 1- {1- [4- methoxy- 6- (pyrrolidin- 1- yl)- 1,3,5- triazin- 2- yl]- 5- methyl- 1H- 1,2,3- triazol- 4- yl}ethanone
Smiles: COc1nc(nc(n1)n1nnc(c1C)C(=O)C)N1CCCC1

STK681890
Synonyms: 8,9,10,12- tetrahydrobenzo[a]acridin- 11(7H)- one
Smiles: O=C1CCCC2=C1Cc1c(N2)ccc2c1cccc2

STK681894
Synonyms: 4- (2- chlorophenyl)- 5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepine
Smiles: Clc1ccccc1C1NCc2c(n3c1ccc3)cccc2

STK772667
Synonyms: 4- (5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepin- 4- yl)benzonitrile
Smiles: N#Cc1ccc(cc1)C1NCc2c(n3c1ccc3)cccc2

STK681898
Synonyms: 2- (5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepin- 4- yl)- 6- ethoxyphenol
Smiles: CCOc1cccc(c1O)C1NCc2c(n3c1ccc3)cccc2

STK772668
Synonyms: N- (4- fluorophenyl)- 5- methyl- 6- phenylthieno[2,3- d]pyrimidin- 4- amine
Smiles: Fc1ccc(cc1)Nc1ncnc2c1c(C)c(s2)c1ccccc1

STK772669
Synonyms: 6- tert- butyl- 1- (2- nitrophenyl)- 3a,4,4a,7a,8,8a- hexahydro- 4,8- methano[1,2,3]triazolo[4,5- f]isoindole- 5,7(1H,6H)- dione
Smiles: O=C1C2C3CC(C2C(=O)N1C(C)(C)C)C1C3N(N=N1)c1ccccc1[N+](=O)[O-]

STK681899
Synonyms: 3,3- dimethyl- 2- oxobutyl4- amino- 1,2,5- oxadiazole- 3- carboxylate
Smiles: O=C(c1nonc1N)OCC(=O)C(C)(C)C

STK772671
Synonyms: 4- chloro- 2,1,3- benzothiadiazol- 5- amine
Smiles: Nc1ccc2c(c1Cl)nsn2

STK681900
Synonyms: 2- hydroxy- 8- methoxyquinoline- 4- carboxylicacid
Smiles: COc1cccc2c1nc(O)cc2C(=O)O

STK772672
Synonyms: ethyl8- chloro- 2- oxo- 4- phenyl- 1,2- dihydro[1]benzofuro[3,2- b]pyridine- 3- carboxylate
Smiles: CCOC(=O)c1c(=O)[nH]c2c(c1c1ccccc1)oc1c2cc(cc1)Cl

STK772675
Synonyms: 1- {5- methyl- 1- [4- (1H- pyrrol- 1- yl)- 1,2,5- oxadiazol- 3- yl]- 1H- 1,2,3- triazol- 4- yl}ethanone
Smiles: CC(=O)c1nnn(c1C)c1nonc1n1cccc1

STK681901
Synonyms: 1- methylpiperidin- 4- yl2- oxo- 2H- chromene- 3- carboxylate
Smiles: CN1CCC(CC1)OC(=O)c1cc2ccccc2oc1=O

STK772676
Synonyms: N,1- dibenzyl- 5- [(trifluoroacetyl)amino]- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: O=C(c1nnn(c1NC(=O)C(F)(F)F)Cc1ccccc1)NCc1ccccc1

STK772677
Synonyms: 1- benzyl- N- (2- methoxyphenyl)- 5- [(trifluoroacetyl)amino]- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: COc1ccccc1NC(=O)c1nnn(c1NC(=O)C(F)(F)F)Cc1ccccc1

STK772679
Synonyms: 1- benzyl- N- phenyl- 5- [(trifluoroacetyl)amino]- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: O=C(c1nnn(c1NC(=O)C(F)(F)F)Cc1ccccc1)Nc1ccccc1

STK681902
Synonyms: 5- (acetylamino)- 1- benzyl- N- methyl- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: CNC(=O)c1nnn(c1NC(=O)C)Cc1ccccc1

STK681903
Synonyms: 5- (acetylamino)- 1- benzyl- N- (2- methoxyphenyl)- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: COc1ccccc1NC(=O)c1nnn(c1NC(=O)C)Cc1ccccc1

STK772680
Synonyms: 7,7- dimethyl- 5- (5- nitrofuran- 2- yl)- 1,5,6,7,8,10- hexahydropyrimido[4,5- b]quinoline- 2,4,9(3H)- trione
Smiles: O=C1CC(C)(C)CC2=C1Nc1[nH]c(=O)[nH]c(=O)c1C2c1ccc(o1)[N+](=O)[O-]

STK681905
Synonyms: 2- chloro- 4- (5,6- dihydro- 4H- pyrrolo[1,2- a][1,4]benzodiazepin- 4- yl)phenol
Smiles: Oc1ccc(cc1Cl)C1NCc2c(n3c1ccc3)cccc2

STK681906
Synonyms: (2E)- 3- (2- chlorophenyl)- N- (3- methylpent- 1- yn- 3- yl)prop- 2- enamide
Smiles: CCC(NC(=O)/C=C/c1ccccc1Cl)(C#C)C

STK681907
Synonyms: 3- nitrotricyclo[3.3.1.1~3,7~]decane- 1- carboxylicacid
Smiles: OC(=O)C12CC3CC(C1)CC(C2)(C3)[N+](=O)[O-]

STK681912
Synonyms: (2Z)- 4- oxo- 4- {[2- (pyridin- 4- yl)ethyl]amino}but- 2- enoicacid
Smiles: O=C(/C=C\C(=O)O)NCCc1ccncc1

STK681916
Synonyms: 6- ethoxytetrazolo[1,5- b]pyridazine
Smiles: CCOc1ccc2n(n1)nnn2

STK772696
Synonyms: 1,1'- [1- (2,5- dimethylphenyl)- 2,5- dimethyl- 1H- pyrrole- 3,4- diyl]diethanone
Smiles: Cc1ccc(c(c1)n1c(C)c(c(c1C)C(=O)C)C(=O)C)C

STK772698
Synonyms: 5- (acetylamino)- N,1- dibenzyl- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: CC(=O)Nc1n(nnc1C(=O)NCc1ccccc1)Cc1ccccc1

STK681917
Synonyms: 1- benzyl- N- phenyl- 5- [(phenylcarbonyl)amino]- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: O=C(c1ccccc1)Nc1n(nnc1C(=O)Nc1ccccc1)Cc1ccccc1

STK681920
Synonyms: 9- pentofuranosyl- 9H- purine- 2,6- diol
Smiles: OCC1OC(C(C1O)O)n1cnc2c1nc(O)nc2O

STK772704
Synonyms: methyl4- [5- chloro- 3- ({[4- (trifluoromethyl)phenyl]carbonyl}amino)- 1- benzofuran- 2- yl]- 4- oxobutanoate
Smiles: COC(=O)CCC(=O)c1oc2c(c1NC(=O)c1ccc(cc1)C(F)(F)F)cc(cc2)Cl

STK681921
Synonyms: 5- amino- 3- methyl- 1,2- oxazole- 4- carboxylicacid
Smiles: OC(=O)c1c(N)onc1C

STK772721
Synonyms: methyl3,3,3- trifluoro- 2- (4- {[(4- fluorophenyl)carbonyl]amino}- 3,5- dimethylphenyl)- 2- hydroxypropanoate
Smiles: COC(=O)C(C(F)(F)F)(c1cc(C)c(c(c1)C)NC(=O)c1ccc(cc1)F)O

STK772722
Synonyms: 2- hydroxy- 6- nitro- 2- (trifluoromethyl)- 2H- 1,4- benzoxazin- 3(4H)- one
Smiles: O=C1Nc2cc(ccc2OC1(O)C(F)(F)F)[N+](=O)[O-]

STK772724
Synonyms: 3- chloro- 6- methyl- 3- (trifluoromethyl)- 1,3- dihydro- 2H- indol- 2- one
Smiles: Cc1ccc2c(c1)NC(=O)C2(Cl)C(F)(F)F

STK772725
Synonyms: 4- methyl- 2- phenyl- 6- (piperidin- 1- yl)pyrimidine
Smiles: Cc1cc(nc(n1)c1ccccc1)N1CCCCC1

STK681930
Synonyms: 3- (4- ethoxyphenyl)- 3- {[(4- methylphenyl)carbonyl]amino}propanoicacid
Smiles: CCOc1ccc(cc1)C(NC(=O)c1ccc(cc1)C)CC(=O)O

STK681931
Synonyms: 1- O- [6- oxo- 5,7- di(propan- 2- yl)- 1,3- diazatricyclo[3.3.1.1~3,7~]dec- 2- yl]pentitol
Smiles: OCC(C(C(COC1N2CC3(CN1CC(C2)(C3=O)C(C)C)C(C)C)O)O)O

STK772726
Synonyms: 3- {[(4- phenyltetrahydro- 2H- pyran- 4- yl)carbonyl]amino}propyl1- phenylcyclohexanecarboxylate
Smiles: O=C(C1(CCOCC1)c1ccccc1)NCCCOC(=O)C1(CCCCC1)c1ccccc1

STK772736
Synonyms: 3- [4- (morpholin- 4- yl)- 6- (propylamino)- 1,3,5- triazin- 2- yl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: CCCNc1nc(nc(n1)N1CCOCC1)N1CC2CC(C1)c1n(C2)c(=O)ccc1

STK772737
Synonyms: 3- (4- {[2- (cyclohex- 1- en- 1- yl)ethyl]amino}- 6- methoxy- 1,3,5- triazin- 2- yl)- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: COc1nc(NCCC2=CCCCC2)nc(n1)N1CC2CC(C1)c1n(C2)c(=O)ccc1

STK772738
Synonyms: 3- (4- {[2- (cyclohex- 1- en- 1- yl)ethyl]amino}- 6- ethoxy- 1,3,5- triazin- 2- yl)- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: CCOc1nc(NCCC2=CCCCC2)nc(n1)N1CC2CC(C1)c1n(C2)c(=O)ccc1

STK681936
Synonyms: (1Z,2Z,3E,4Z,5Z,6E)- N,N',N'',N''',N'''',N'''''- hexahydroxycyclohexane- 1,2,3,4,5,6- hexaimine
Smiles: O/N=C/1\C(=N\O)\C(=N/O)\C(=N\O)\C(=N\O)\C1=N/O

STK772743
Synonyms: dimethyl4- (3- chloro- 4- hydroxy- 5- methoxyphenyl)- 1- (tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl)- 1,4- dihydropyridine- 3,5- dicarboxylate
Smiles: COC(=O)C1=CN(C=C(C1c1cc(Cl)c(c(c1)OC)O)C(=O)OC)CC12CC3CC(C2)CC(C1)C3

STK772752
Synonyms: dimethyl4- [2- (propan- 2- yloxy)phenyl]- 1- [2- (tricyclo[3.3.1.1~3,7~]dec- 1- yloxy)ethyl]- 1,4- dihydropyridine- 3,5- dicarboxylate
Smiles: COC(=O)C1=CN(CCOC23CC4CC(C3)CC(C2)C4)C=C(C1c1ccccc1OC(C)C)C(=O)OC

STK681937
Synonyms: 4- (trifluoromethoxy)- N- ({4- [3- (trifluoromethyl)phenyl]- 1,3- thiazol- 2- yl}carbamoyl)benzenesulfonamide
Smiles: O=C(NS(=O)(=O)c1ccc(cc1)OC(F)(F)F)Nc1scc(n1)c1cccc(c1)C(F)(F)F

STK772757
Synonyms: 3a'- (4- fluorophenyl)dihydrodispiro[cyclohexane- 1,3'- furo[3,2- b]furan- 6',1''- cyclohexane]- 2',5'- dione
Smiles: Fc1ccc(cc1)C12OC(=O)C3(C1OC(=O)C12CCCCC1)CCCCC3

STK681941
Synonyms: (1S,2S,5R)- 2- {5- [4- (methylsulfanyl)phenyl]- 1H- tetrazol- 1- yl}- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: CSc1ccc(cc1)c1nnnn1[C@H]1CC(=O)[C@H]2O[C@@H]1CO2

STK772758
Synonyms: (1S,2S,5R)- 2- [5- (4- methoxyphenyl)- 1H- tetrazol- 1- yl]- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: COc1ccc(cc1)c1nnnn1[C@H]1CC(=O)[C@H]2O[C@@H]1CO2

STK681943
Synonyms: azepan- 1- yl(2- methyl- 1,3- benzoxazol- 7- yl)methanone
Smiles: O=C(c1cccc2c1oc(n2)C)N1CCCCCC1

STK681944
Synonyms: 2- methyl- N- (2- methylpropyl)- 1,3- benzoxazole- 7- carboxamide
Smiles: CC(CNC(=O)c1cccc2c1oc(n2)C)C

STK681945
Synonyms: (2- methyl- 1,3- benzoxazol- 7- yl)(4- phenylpiperazin- 1- yl)methanone
Smiles: Cc1nc2c(o1)c(ccc2)C(=O)N1CCN(CC1)c1ccccc1

STK772760
Synonyms: 1- [2- (2- methyl- 1H- indol- 3- yl)ethyl]- 3- propylurea
Smiles: CCCNC(=O)NCCc1c(C)[nH]c2c1cccc2

STK772763
Synonyms: 3,6,8- trimethyl- 5,7- dioxo- 5,6,7,8- tetrahydro- 1H- pyrazolo[4',3':5,6]pyrido[2,3- d]pyrimidin- 4- ylacetate
Smiles: CC(=O)Oc1c2c(C)n[nH]c2nc2c1c(=O)n(C)c(=O)n2C

STK772764
Synonyms: 3,6,8- trimethyl- 5,7- dioxo- 5,6,7,8- tetrahydro- 1H- pyrazolo[4',3':5,6]pyrido[2,3- d]pyrimidin- 4- ylbenzoate
Smiles: O=C(c1ccccc1)Oc1c2c(C)n[nH]c2nc2c1c(=O)n(C)c(=O)n2C

STK772765
Synonyms: 4,4'- piperazine- 1,4- diylbis(6- chloropyrimidin- 5- amine)
Smiles: Nc1c(ncnc1Cl)N1CCN(CC1)c1ncnc(c1N)Cl

STK681946
Synonyms: 2- ({2- [(3- amino- 4- nitro- 1H- pyrazol- 5- yl)amino]ethyl}amino)ethanol
Smiles: [O-][N+](=O)c1c(NCCNCCO)[nH]nc1N

STK772769
Synonyms: 2- (benzylamino)- N- phenylpyridine- 3- carboxamide
Smiles: O=C(c1cccnc1NCc1ccccc1)Nc1ccccc1

STK772770
Synonyms: N- (4- methoxyphenyl)- 2- (piperidin- 1- yl)pyridine- 3- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1cccnc1N1CCCCC1

STK772775
Synonyms: N- (3- fluorophenyl)- 2- [(2- phenylethyl)amino]pyridine- 3- carboxamide
Smiles: Fc1cccc(c1)NC(=O)c1cccnc1NCCc1ccccc1

STK681947
Synonyms: ethyl2- [(4- chlorophenyl)carbonyl]- 2- methyl- 3- (propan- 2- ylidene)cyclopropanecarboxylate
Smiles: CCOC(=O)C1C(=C(C)C)C1(C)C(=O)c1ccc(cc1)Cl

STK772777
Synonyms: 1- benzyl- 3- [2- (4- methoxyphenyl)ethyl]thiourea
Smiles: COc1ccc(cc1)CCNC(=S)NCc1ccccc1

STK681948
Synonyms: 2- [(3- fluorobenzyl)sulfonyl]- 3H- imidazo[4,5- b]pyridine
Smiles: Fc1cccc(c1)CS(=O)(=O)c1nc2c([nH]1)nccc2

STK681949
Synonyms: 5- benzyl- 3- (2- hydroxy- 5- methoxyphenyl)- 4,6- dioxo- 1- propyloctahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: CCCC1(NC(C2C1C(=O)N(C2=O)Cc1ccccc1)c1cc(OC)ccc1O)C(=O)O

STK681950
Synonyms: methyl4- [(3H- imidazo[4,5- b]pyridin- 2- ylsulfonyl)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)CS(=O)(=O)c1nc2c([nH]1)nccc2

STK681951
Synonyms: N- [(4S,5S)- 2,2- dimethyl- 4- phenyl- 1,3- dioxan- 5- yl]- 4- methoxyquinoline- 2- carboxamide
Smiles: COc1cc(nc2c1cccc2)C(=O)N[C@H]1COC(O[C@H]1c1ccccc1)(C)C

STK772779
Synonyms: 2- {[(4Z)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}- N- (2,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CO/N=C\1/CCCc2c1non2

STK772780
Synonyms: N- (2,4- dimethoxyphenyl)- 2- {[4- (morpholin- 4- yl)- 1,2,5- thiadiazol- 3- yl]oxy}acetamide
Smiles: COc1cc(OC)ccc1NC(=O)COc1nsnc1N1CCOCC1

STK772781
Synonyms: N- (2- butoxyphenyl)- 2- [5- (2- chlorophenyl)- 2H- tetrazol- 2- yl]acetamide
Smiles: CCCCOc1ccccc1NC(=O)Cn1nnc(n1)c1ccccc1Cl

STK681953
Synonyms: 3,7- dimethyl- 1- [4- (1H- tetrazol- 5- yl)benzyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1n(Cc2ccc(cc2)c2[nH]nnn2)c(=O)c2c(n1C)ncn2C

STK772786
Synonyms: 5- {4- [(2- fluorobenzyl)oxy]phenyl}- 2- (4- methylbenzyl)- 2H- tetrazole
Smiles: Cc1ccc(cc1)Cn1nnc(n1)c1ccc(cc1)OCc1ccccc1F

STK681956
Synonyms: 5- (4- {[3- (trifluoromethyl)benzyl]oxy}phenyl)- 1H- tetrazole
Smiles: FC(c1cccc(c1)COc1ccc(cc1)c1nnn[nH]1)(F)F

STK772788
Synonyms: 4- {[3- (trifluoromethyl)benzyl]oxy}benzonitrile
Smiles: N#Cc1ccc(cc1)OCc1cccc(c1)C(F)(F)F

STK681958
Synonyms: 4- methoxy- N- (1- methylpiperidin- 4- yl)quinoline- 2- carboxamide
Smiles: COc1cc(nc2c1cccc2)C(=O)NC1CCN(CC1)C

STK681962
Synonyms: N- (1- methylpiperidin- 4- yl)- beta- alanine
Smiles: CN1CCC(CC1)NCCC(=O)O

STK681963
Synonyms: 3- [(2,5- dioxopyrrolidin- 1- yl)methyl]- 5- oxo- 5H- 1,2,3- oxadiazol- 3- ium- 2- ide
Smiles: O=C1CCC(=O)N1C[n+]1[n-]oc(=O)c1

STK772796
Synonyms: 7- (3,4- dimethoxyphenyl)- 7,10,11,12- tetrahydrobenzo[b][1,7]phenanthrolin- 8(9H)- one
Smiles: COc1ccc(cc1OC)C1C2=C(CCCC2=O)Nc2c1ccc1c2cccn1

STK681965
Synonyms: 4- [6- (acetyloxy)- 7- chloro- 1,2,3,9a- tetrahydro- 3aH- spiro[cyclopenta[b]chromene- 9,1'- cyclopentan]- 3a- yl]- 6- chlorobenzene- 1,3- diyldiacetate
Smiles: CC(=O)Oc1cc(OC(=O)C)c(cc1C12CCCC2C2(c3c(O1)cc(OC(=O)C)c(c3)Cl)CCCC2)Cl

STK772801
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- (4H- 1,2,4- triazol- 3- yl)acetamide
Smiles: COc1cc(CCNC(=O)Cc2nnc[nH]2)ccc1OC

STK772808
Synonyms: 6- (3- chlorophenyl)- 1- methyl- 4- phenyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: Clc1cccc(c1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccccc1

STK772809
Synonyms: 6- (4- ethylphenyl)- 2,3- dimethylimidazo[1,2- b][1,2,4]triazine
Smiles: CCc1ccc(cc1)c1cn2c(n1)nc(c(n2)C)C

STK681969
Synonyms: 4- [(4- cyclopropyl- 1,3- thiazol- 2- yl)amino]benzenesulfonamide
Smiles: NS(=O)(=O)c1ccc(cc1)Nc1scc(n1)C1CC1

STK772811
Synonyms: 4- cyclopropyl- N- (4- methylphenyl)- 1,3- thiazol- 2- amine
Smiles: Cc1ccc(cc1)Nc1scc(n1)C1CC1

STK772812
Synonyms: N- [(3Z)- 6,7- dihydro- 5H- pyrrolo[1,2- c][1,3]thiazol- 3- ylidene]- 4- methylaniline
Smiles: Cc1ccc(cc1)/N=c/1\scc2n1CCC2

STK772817
Synonyms: 8- (4- hydroxybutyl)- 1- methyl- 7- phenyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: OCCCCn1c(cn2c1nc1c2c(=O)[nH]c(=O)n1C)c1ccccc1

STK681972
Synonyms: 4- methyl- N- [(1- propyl- 1H- benzimidazol- 2- yl)methyl]benzenesulfonamide
Smiles: CCCn1c(CNS(=O)(=O)c2ccc(cc2)C)nc2c1cccc2

STK681974
Synonyms: 5- bromo- 3,3- bis(trifluoromethyl)- 2- azabicyclo[2.2.1]hept- 6- ylacetate
Smiles: CC(=O)OC1C2CC(C1Br)C(N2)(C(F)(F)F)C(F)(F)F

STK681977
Synonyms: methyl4- [({[(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CO/N=C/1\CCCc2c1non2

STK681980
Synonyms: (1'S,2'S,5'R)- 2,2'- [ethane- 1,2- diylbis(5- thioxo- 1H- tetrazole- 4,1(5H)- diyl)]bis(6,8- dioxabicyclo[3.2.1]octan- 4- one)(non- preferredname)
Smiles: O=C1CC(C2OC1OC2)n1nnn(c1=S)CCn1nnn(c1=S)[C@H]1CC(=O)[C@H]2O[C@@H]1CO2

STK681981
Synonyms: N- {4- [chloro(difluoro)methoxy]phenyl}- 2- {[1- (4- iodophenyl)- 1H- tetrazol- 5- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OC(Cl)(F)F)CSc1nnnn1c1ccc(cc1)I

STK681983
Synonyms: 5- (1,3- benzodioxol- 5- yl)- 3- benzyl- 2- thioxo- 2,3- dihydro[1,3]thiazolo[4,5- d]pyrimidin- 7(6H)- one
Smiles: O=c1[nH]c(nc2c1sc(=S)n2Cc1ccccc1)c1ccc2c(c1)OCO2

STK772836
Synonyms: 5- (1,3- benzodioxol- 5- yl)- 3- (prop- 2- en- 1- yl)- 2- thioxo- 2,3- dihydro[1,3]thiazolo[4,5- d]pyrimidin- 7(6H)- one
Smiles: C=CCn1c(=S)sc2c1nc([nH]c2=O)c1ccc2c(c1)OCO2

STK772837
Synonyms: 5- (4- methoxyphenyl)- 3- (prop- 2- en- 1- yl)- 2- thioxo- 2,3- dihydro[1,3]thiazolo[4,5- d]pyrimidin- 7(6H)- one
Smiles: C=CCn1c(=S)sc2c1nc([nH]c2=O)c1ccc(cc1)OC

STK772838
Synonyms: 5- (3,4- dimethoxyphenyl)- 3- (prop- 2- en- 1- yl)- 2- thioxo- 2,3- dihydro[1,3]thiazolo[4,5- d]pyrimidin- 7(6H)- one
Smiles: C=CCn1c(=S)sc2c1nc([nH]c2=O)c1ccc(c(c1)OC)OC

STK772839
Synonyms: N- [4- (3'- ethyl- 1- methyl- 2,4',6'- trioxo- 1,2,2',3',3a',4',6',6a'- octahydro- 5'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 5'- yl)phenyl]acetamide
Smiles: CCC1NC2(C3C1C(=O)N(C3=O)c1ccc(cc1)NC(=O)C)c1ccccc1N(C2=O)C

STK772844
Synonyms: 3- (4- bromophenyl)- 2- phenyl- 2- azaspiro[3.5]nonan- 1- one
Smiles: Brc1ccc(cc1)C1N(c2ccccc2)C(=O)C21CCCCC2

STK681989
Synonyms: 4- (2- hydroxyphenyl)- 3,3- dimethyl- 1- phenylazetidin- 2- one
Smiles: Oc1ccccc1C1N(c2ccccc2)C(=O)C1(C)C

STK681990
Synonyms: 1- methyl- 3- (4- methylphenyl)- 4a,10b- dihydro- 2H- chromeno[3,4- c]pyridine- 2,4,5(1H,3H)- trione
Smiles: Cc1ccc(cc1)N1C(=O)C(C)C2C(C1=O)C(=O)Oc1c2cccc1

STK772845
Synonyms: 1- ethyl- 3- (4- methylphenyl)- 4a,10b- dihydro- 2H- chromeno[3,4- c]pyridine- 2,4,5(1H,3H)- trione
Smiles: CCC1C(=O)N(c2ccc(cc2)C)C(=O)C2C1c1ccccc1OC2=O

STK681991
Synonyms: 4- (1H- imidazol- 1- yl)- N- methyl- N- phenyl- 6- (pyrrolidin- 1- yl)- 1,3,5- triazin- 2- amine
Smiles: CN(c1nc(nc(n1)n1ccnc1)N1CCCC1)c1ccccc1

STK772848
Synonyms: 12- (4- chlorophenyl)- 9,9- dimethyl- 8,9,10,12- tetrahydrobenzo[b][4,7]phenanthrolin- 11(7H)- one
Smiles: Clc1ccc(cc1)C1C2=C(Nc3c1c1cccnc1cc3)CC(CC2=O)(C)C

STK772850
Synonyms: N- [2- (5- methoxy- 2- methyl- 1H- indol- 3- yl)ethyl]- 2- nitro- 4- (trifluoromethyl)aniline
Smiles: COc1ccc2c(c1)c(CCNc1ccc(cc1[N+](=O)[O-])C(F)(F)F)c([nH]2)C

STK772851
Synonyms: methyl4- (5- chloro- 3- {[4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)butanoyl]amino}- 1- benzofuran- 2- yl)- 4- oxobutanoate
Smiles: COC(=O)CCC(=O)c1oc2c(c1NC(=O)CCCN1C(=O)c3c(C1=O)cccc3)cc(cc2)Cl

STK772858
Synonyms: 2- amino- 9- bromo- 5- oxo- 4- phenyl- 4a,10b- dihydro- 4H,5H- thiopyrano[3,4- c]chromene- 1- carbonitrile
Smiles: N#CC1=C(N)SC(C2C1c1cc(Br)ccc1OC2=O)c1ccccc1

STK772862
Synonyms: 2,2,2- trifluoroethyl2- [(tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl)carbamoyl]cyclohexanecarboxylate
Smiles: O=C(C1CCCCC1C(=O)OCC(F)(F)F)NCC12CC3CC(C2)CC(C1)C3

STK772864
Synonyms: 3- ethyl- 5- (4- fluorophenyl)- 2- thioxo- 2,3- dihydro[1,3]thiazolo[4,5- d]pyrimidin- 7(6H)- one
Smiles: CCn1c(=S)sc2c1nc([nH]c2=O)c1ccc(cc1)F

STK681994
Synonyms: ethyl5- hydroxy- 2- (pyrrolidin- 1- ylmethyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(CN2CCCC2)oc2c1cc(O)cc2

STK682000
Synonyms: N- (tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl)pyrazolo[1,5- a]pyrimidine- 3- carboxamide
Smiles: O=C(c1cnn2c1nccc2)NCC12CC3CC(C2)CC(C1)C3

STK772875
Synonyms: N- (diphenylmethyl)- 2- (1H- indol- 3- yl)- 2- oxoacetamide
Smiles: O=C(C(=O)c1c[nH]c2c1cccc2)NC(c1ccccc1)c1ccccc1

STK772880
Synonyms: 7- bromo- 6- fluoro- 3,3- bis(trifluoromethyl)- 2- azabicyclo[2.2.1]heptane
Smiles: FC1CC2C(C1NC2(C(F)(F)F)C(F)(F)F)Br

STK682004
Synonyms: 5- iodo- 3,3- bis(trifluoromethyl)- 2- azabicyclo[2.2.1]hept- 6- ylacetate
Smiles: CC(=O)OC1C2CC(C1I)C(N2)(C(F)(F)F)C(F)(F)F

STK682005
Synonyms: 4- {3- acetyl- 4- [(4- methylphenyl)amino]- 5- oxo- 2- phenyl- 2,5- dihydro- 1H- pyrrol- 1- yl}butanoicacid
Smiles: OC(=O)CCCN1C(=O)C(=C(C1c1ccccc1)C(=O)C)Nc1ccc(cc1)C

STK772882
Synonyms: 4- fluoro- N- {[4- methyl- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}benzamide
Smiles: O=C(NC(=O)c1ccc(cc1)F)Nc1nc(C)cc(n1)C(F)(F)F

STK682008
Synonyms: 3- (4- chlorophenyl)- 3- [(naphthalen- 1- ylacetyl)amino]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)Cl)NC(=O)Cc1cccc2c1cccc2

STK682010
Synonyms: 3- {[(4- chloro- 3,5- dimethylphenoxy)acetyl]amino}- 3- (4- chlorophenyl)propanoicacid
Smiles: O=C(NC(c1ccc(cc1)Cl)CC(=O)O)COc1cc(C)c(c(c1)C)Cl

STK682012
Synonyms: 3- (4- chlorophenyl)- 3- {[(3- methylphenyl)carbonyl]amino}propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)Cl)NC(=O)c1cccc(c1)C

STK682014
Synonyms: 4- oxo- 4- {[2- (pyridin- 4- yl)ethyl]amino}butanoicacid
Smiles: O=C(CCC(=O)O)NCCc1ccncc1

STK682015
Synonyms: 4- {[(4- methylphenyl)carbonyl]amino}- 1- pentofuranosylpyrimidin- 2(1H)- one
Smiles: OCC1OC(C(C1O)O)n1ccc(nc1=O)NC(=O)c1ccc(cc1)C

STK772885
Synonyms: 6- (4- methoxyphenyl)- 4- (thiophen- 2- yl)- 3,4- dihydropyrimidine- 2(1H)- thione
Smiles: COc1ccc(cc1)C1=CC(NC(=S)N1)c1cccs1

STK772897
Synonyms: 1- [4,6- di(pyrrolidin- 1- yl)- 1,3,5- triazin- 2- yl]hydrazinecarboxamide
Smiles: NN(c1nc(nc(n1)N1CCCC1)N1CCCC1)C(=O)N

STK682018
Synonyms: N'- hydroxy- 4,6- di(pyrrolidin- 1- yl)- 1,3,5- triazine- 2- carboximidamide
Smiles: O/N=C(\c1nc(nc(n1)N1CCCC1)N1CCCC1)/N

STK772898
Synonyms: ethyl1- [4- methoxy- 6- (piperidin- 1- yl)- 1,3,5- triazin- 2- yl]- 5- phenyl- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccccc1)c1nc(OC)nc(n1)N1CCCCC1

STK772901
Synonyms: {[4- methoxy- 6- (pyrrolidin- 1- yl)- 1,3,5- triazin- 2- yl]oxy}acetonitrile
Smiles: N#CCOc1nc(nc(n1)OC)N1CCCC1

STK772902
Synonyms: 4,6- di(pyrrolidin- 1- yl)- 1,3,5- triazine- 2- carbonitrile
Smiles: N#Cc1nc(nc(n1)N1CCCC1)N1CCCC1

STK772904
Synonyms: 1- {1- [4,6- di(pyrrolidin- 1- yl)- 1,3,5- triazin- 2- yl]- 5- methyl- 1H- 1,2,3- triazol- 4- yl}ethanone
Smiles: CC(=O)c1nnn(c1C)c1nc(nc(n1)N1CCCC1)N1CCCC1

STK682019
Synonyms: 4- methoxy- 6- (pyrrolidin- 1- yl)- 1,3,5- triazin- 2(1H)- one
Smiles: COc1nc([nH]c(=O)n1)N1CCCC1

STK772906
Synonyms: ethyl1- [4- methoxy- 6- (pyrrolidin- 1- yl)- 1,3,5- triazin- 2- yl]- 5- phenyl- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccccc1)c1nc(OC)nc(n1)N1CCCC1

STK772907
Synonyms: N'- hydroxy- 4- methoxy- 6- (piperidin- 1- yl)- 1,3,5- triazine- 2- carboximidamide
Smiles: O/N=C(\c1nc(nc(n1)OC)N1CCCCC1)/N

STK682021
Synonyms: 6- [(4- nitrophenyl)amino]- 1,3,5- triazine- 2,4(1H,3H)- dione
Smiles: O=c1nc(Nc2ccc(cc2)[N+](=O)[O-])[nH]c(=O)[nH]1

STK682022
Synonyms: 1- [4- methoxy- 6- (pyrrolidin- 1- yl)- 1,3,5- triazin- 2- yl]hydrazinecarboxamide
Smiles: COc1nc(nc(n1)N(C(=O)N)N)N1CCCC1

STK772910
Synonyms: ethyl1- [4,6- di(pyrrolidin- 1- yl)- 1,3,5- triazin- 2- yl]- 5- methyl- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1C)c1nc(nc(n1)N1CCCC1)N1CCCC1

STK772924
Synonyms: 3- amino- N- benzyl- N- ethyl- 4,6- dimethylthieno[2,3- b]pyridine- 2- carboxamide
Smiles: CCN(C(=O)c1sc2c(c1N)c(C)cc(n2)C)Cc1ccccc1

STK772928
Synonyms: 4- chloro- N- {3- [(3- cyano- 4,6- dimethylpyridin- 2- yl)oxy]phenyl}benzamide
Smiles: N#Cc1c(C)cc(nc1Oc1cccc(c1)NC(=O)c1ccc(cc1)Cl)C

STK772929
Synonyms: N- {3- [(3- cyano- 4,6- dimethylpyridin- 2- yl)oxy]phenyl}acetamide
Smiles: N#Cc1c(C)cc(nc1Oc1cccc(c1)NC(=O)C)C

STK772930
Synonyms: 3- amino- N- tert- butyl- 4,5,6- trimethylthieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c(C)c(c(n2)C)C)NC(C)(C)C

STK772933
Synonyms: 3- amino- 5- chloro- N,4,6- trimethyl- N- phenylthieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c(C)c(c(n2)C)Cl)N(c1ccccc1)C

STK772934
Synonyms: 4,6- dimethyl- 2- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]pyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(nc1Sc1nnnn1c1ccccc1)C

STK772935
Synonyms: N- (3,5- dimethylphenyl)- 8- methoxyquinoline- 5- sulfonamide
Smiles: COc1ccc(c2c1nccc2)S(=O)(=O)Nc1cc(C)cc(c1)C

STK772939
Synonyms: 2,5,6- trichloro- 4- methyl- N- (prop- 2- en- 1- ylcarbamoyl)pyridine- 3- carboxamide
Smiles: C=CCNC(=O)NC(=O)c1c(Cl)nc(c(c1C)Cl)Cl

STK772940
Synonyms: 8- methoxy- N,N- bis(2- methylpropyl)quinoline- 5- sulfonamide
Smiles: COc1ccc(c2c1nccc2)S(=O)(=O)N(CC(C)C)CC(C)C

STK772941
Synonyms: 8- methoxy- N,N- dipropylquinoline- 5- sulfonamide
Smiles: CCCN(S(=O)(=O)c1ccc(c2c1cccn2)OC)CCC

STK772946
Synonyms: 2,5- dichloro- N- (3- fluorophenyl)- 4,6- dimethylpyridine- 3- carboxamide
Smiles: Fc1cccc(c1)NC(=O)c1c(Cl)nc(c(c1C)Cl)C

STK682032
Synonyms: 3- [(benzylsulfonyl)amino]- 3- (4- ethoxyphenyl)propanoicacid
Smiles: CCOc1ccc(cc1)C(NS(=O)(=O)Cc1ccccc1)CC(=O)O

STK772954
Synonyms: N- (4- acetylphenyl)- 4- phenyltetrahydro- 2H- pyran- 4- carboxamide
Smiles: O=C(C1(CCOCC1)c1ccccc1)Nc1ccc(cc1)C(=O)C

STK772962
Synonyms: 7,7- dimethyl- 2- oxo- N,N- dipropyl- 1,8- dioxaspiro[4.5]decane- 4- carboxamide
Smiles: CCCN(C(=O)C1CC(=O)OC21CCOC(C2)(C)C)CCC

STK772966
Synonyms: 5- methyl- 2- (4- methylphenyl)- 7- propyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1ccc(cc1)C)C

STK682039
Synonyms: 2- (1,3- benzodioxol- 5- yl)- 5- methyl- 7- propyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1ccc2c(c1)OCO2)C

STK682041
Synonyms: 2- (1H- indol- 3- yl)- 5- methyl- 7- propyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1c[nH]c2c1cccc2)C

STK772972
Synonyms: 4- (2,4- dichlorophenyl)- 1- phenyl- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Clc1ccc(c(c1)Cl)C1CC(=O)N(C2=C1C(=O)CCC2)c1ccccc1

STK772976
Synonyms: 7,7- dimethyl- 1- phenyl- 4- (pyridin- 3- yl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CC(C)(C)CC2=C1C(CC(=O)N2c1ccccc1)c1cccnc1

STK682046
Synonyms: 1- (4- fluorophenyl)- 4- (4- methylphenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Cc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)c1ccc(cc1)F

STK772977
Synonyms: 1- (4- fluorophenyl)- 4- (2- methylphenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)CC(C2=C1CCCC2=O)c1ccccc1C

STK772981
Synonyms: 4- (4- chlorophenyl)- 1- (2- fluorophenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Clc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)c1ccccc1F

STK772982
Synonyms: 4- (2- chlorophenyl)- 1- (2- fluorophenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CCCC2=C1C(CC(=O)N2c1ccccc1F)c1ccccc1Cl

STK772983
Synonyms: 1- (2- fluorophenyl)- 4- (4- nitrophenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CCCC2=C1C(CC(=O)N2c1ccccc1F)c1ccc(cc1)[N+](=O)[O-]

STK772984
Synonyms: 1- (2- fluorophenyl)- 4- (thiophen- 2- yl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CCCC2=C1C(CC(=O)N2c1ccccc1F)c1cccs1

STK772986
Synonyms: 4- (4- chlorophenyl)- 1- (2- fluorophenyl)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Clc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CC(C2)(C)C)c1ccccc1F

STK772989
Synonyms: 4- (thiophen- 3- yl)- 1- [4- (trifluoromethyl)phenyl]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CC(c2cscc2)C2=C(N1c1ccc(cc1)C(F)(F)F)CCCC2=O

STK772990
Synonyms: 7,7- dimethyl- 4- (thiophen- 2- yl)- 1- [4- (trifluoromethyl)phenyl]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CC(c2cccs2)C2=C(N1c1ccc(cc1)C(F)(F)F)CC(CC2=O)(C)C

STK772995
Synonyms: 4- (4- chlorophenyl)- 1- (4- fluorophenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)CC(C2=C1CCCC2=O)c1ccc(cc1)Cl

STK682048
Synonyms: 4- (2,3- dichlorophenyl)- 1- (4- fluorophenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)CC(C2=C1CCCC2=O)c1cccc(c1Cl)Cl

STK773001
Synonyms: 1- (2,4- difluorophenyl)- 4- (4- methylphenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Cc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)c1ccc(cc1F)F

STK773003
Synonyms: 4- (2- chlorophenyl)- 1- (2,4- difluorophenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(c(c1)F)N1C(=O)CC(C2=C1CCCC2=O)c1ccccc1Cl

STK773004
Synonyms: 4- (2,4- dichlorophenyl)- 1- (2,4- difluorophenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(c(c1)F)N1C(=O)CC(C2=C1CCCC2=O)c1ccc(cc1Cl)Cl

STK682050
Synonyms: 4- (2,3- dichlorophenyl)- 1- (2,4- difluorophenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(c(c1)F)N1C(=O)CC(C2=C1CCCC2=O)c1cccc(c1Cl)Cl

STK682051
Synonyms: 2- [(3- bromobenzyl)sulfonyl]- 3H- imidazo[4,5- b]pyridine
Smiles: Brc1cccc(c1)CS(=O)(=O)c1nc2c([nH]1)nccc2

STK773015
Synonyms: N- (3- acetylphenyl)- 2- {[(4Z)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}acetamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)CO/N=C\1/CCCc2c1non2

STK773017
Synonyms: N- (2- butoxyphenyl)- 2- (5- {4- [(2- fluorobenzyl)oxy]phenyl}- 2H- tetrazol- 2- yl)acetamide
Smiles: CCCCOc1ccccc1NC(=O)Cn1nnc(n1)c1ccc(cc1)OCc1ccccc1F

STK773021
Synonyms: 2- [5- (2- chlorophenyl)- 2H- tetrazol- 2- yl]- N- (3,5- dimethylphenyl)acetamide
Smiles: O=C(Cn1nnc(n1)c1ccccc1Cl)Nc1cc(C)cc(c1)C

STK773022
Synonyms: 7- (4- bromobenzyl)- 8- (butylsulfanyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCSc1nc2c(n1Cc1ccc(cc1)Br)c(=O)n(c(=O)n2C)C

STK682053
Synonyms: 2,6- diamino- 7- hydroxy- 3- nitropyrazolo[1,5- a]pyrimidin- 5(4H)- one
Smiles: [O-][N+](=O)c1c(N)nn2c1[nH]c(=O)c(c2O)N

STK773028
Synonyms: 8- ethyl- 2- [4- (methylcarbamothioyl)piperazin- 1- yl]- 5- oxo- 5,8- dihydropyrido[2,3- d]pyrimidine- 6- carboxylicacid
Smiles: CNC(=S)N1CCN(CC1)c1ncc2c(n1)n(CC)cc(c2=O)C(=O)O

STK773029
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (methylcarbamothioyl)piperazin- 1- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC)c(c2)F

STK682054
Synonyms: N- [1- butyl- 2,5- dioxo- 4- (trifluoromethyl)imidazolidin- 4- yl]- 3- cyclohexylpropanamide
Smiles: CCCCN1C(=O)NC(C1=O)(NC(=O)CCC1CCCCC1)C(F)(F)F

STK682055
Synonyms: methylN- (cyclohexylcarbonyl)- 3,3,3- trifluoro- 2- [(tetrahydrofuran- 2- ylmethyl)amino]alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)C1CCCCC1)NCC1CCCO1

STK773030
Synonyms: 1- [2- (pyridin- 2- yl)ethyl]pyrrolidin- 2- one
Smiles: O=C1CCCN1CCc1ccccn1

STK773031
Synonyms: N- methyl- 2- (thiophen- 2- ylsulfonyl)- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: CNC(=O)C1Cc2ccccc2CN1S(=O)(=O)c1cccs1

STK773039
Synonyms: N- [(1Z)- 1- (4- chlorophenyl)- 3- {[2- (2- methyl- 1H- indol- 3- yl)ethyl]amino}- 3- oxoprop- 1- en- 2- yl]- 2- methoxybenzamide
Smiles: COc1ccccc1C(=O)N/C(=C\c1ccc(cc1)Cl)/C(=O)NCCc1c(C)[nH]c2c1cccc2

STK682059
Synonyms: ethyl5- {[({2- [(2,2,2- trifluoroethoxy)carbonyl]cyclohexyl}carbonyl)amino]methyl}furan- 2- carboxylate
Smiles: CCOC(=O)c1ccc(o1)CNC(=O)C1CCCCC1C(=O)OCC(F)(F)F

STK682060
Synonyms: N- {(1Z)- 3- [(3- methylpent- 1- yn- 3- yl)amino]- 3- oxo- 1- phenylprop- 1- en- 2- yl}benzamide
Smiles: CCC(NC(=O)/C(=C/c1ccccc1)/NC(=O)c1ccccc1)(C#C)C

STK773052
Synonyms: 6- benzyl- 6,6a- dihydro- 11H- isoindolo[1,2- c][1,2,4]benzothiadiazin- 11- one5,5- dioxide
Smiles: O=C1c2ccccc2C2N1c1ccccc1S(=O)(=O)N2Cc1ccccc1

STK773054
Synonyms: N- (2,4- dimethylphenyl)- 2- methyl- 4- [4- (methylsulfanyl)phenyl]- 1,4- dihydropyrimido[1,2- a]benzimidazole- 3- carboxamide
Smiles: CSc1ccc(cc1)C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)Nc1ccc(cc1C)C

STK773059
Synonyms: 4- (6- hydroxy- 5- methyl- 1,2,3,9a- tetrahydro- 3aH- spiro[cyclopenta[b]chromene- 9,1'- cyclopentan]- 3a- yl)- 2- methylbenzene- 1,3- diol
Smiles: Oc1ccc(c(c1C)O)C12CCCC2C2(c3c(O1)c(C)c(O)cc3)CCCC2

STK773060
Synonyms: 4- (6- hydroxy- 1,2,3,9a- tetrahydro- 3aH- spiro[cyclopenta[b]chromene- 9,1'- cyclopentan]- 3a- yl)benzene- 1,3- diol
Smiles: Oc1ccc(c(c1)O)C12CCCC2C2(c3c(O1)cc(O)cc3)CCCC2

STK773064
Synonyms: 2- (1H- imidazol- 1- yl)- 4- phenyl- 6- (4- phenylpiperazin- 1- yl)- 1,3,5- triazine
Smiles: c1ccc(cc1)N1CCN(CC1)c1nc(nc(n1)n1ccnc1)c1ccccc1

STK773069
Synonyms: 4- chloro- N- [4- cyano- 5- methyl- 2- oxo- 3- (trifluoromethyl)- 2,3- dihydro- 1H- pyrrol- 3- yl]benzenesulfonamide
Smiles: N#CC1=C(C)NC(=O)C1(NS(=O)(=O)c1ccc(cc1)Cl)C(F)(F)F

STK773073
Synonyms: N- [1- (4- methoxyphenyl)- 2,5- dioxo- 4- (trifluoromethyl)imidazolidin- 4- yl]thiophene- 2- carboxamide
Smiles: COc1ccc(cc1)N1C(=O)NC(C1=O)(NC(=O)c1cccs1)C(F)(F)F

STK773074
Synonyms: N- [2,5- dioxo- 1- phenyl- 4- (trifluoromethyl)imidazolidin- 4- yl]thiophene- 2- carboxamide
Smiles: O=C1NC(C(=O)N1c1ccccc1)(NC(=O)c1cccs1)C(F)(F)F

STK682066
Synonyms: 4- chloro- N- [1- (furan- 2- ylmethyl)- 2,5- dioxo- 4- (trifluoromethyl)imidazolidin- 4- yl]benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)NC1(NC(=O)N(C1=O)Cc1ccco1)C(F)(F)F

STK682067
Synonyms: 4- chloro- N- {1- [2- (3,4- dimethoxyphenyl)ethyl]- 2,5- dioxo- 4- (trifluoromethyl)imidazolidin- 4- yl}benzenesulfonamide
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(C1=O)(NS(=O)(=O)c1ccc(cc1)Cl)C(F)(F)F

STK773087
Synonyms: 4- chloro- N- [1- methyl- 2,5- dioxo- 4- (trifluoromethyl)imidazolidin- 4- yl]benzenesulfonamide
Smiles: CN1C(=O)NC(C1=O)(NS(=O)(=O)c1ccc(cc1)Cl)C(F)(F)F

STK773088
Synonyms: N- [1- (3,4- dimethylphenyl)- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]- 2- fluorobenzamide
Smiles: O=C1Nc2c(C1(NC(=O)c1ccccc1F)C(F)(F)F)c(=O)[nH]c(=O)n2c1ccc(c(c1)C)C

STK773089
Synonyms: ethyl4- [3- hydroxy- 6,6- dimethyl- 2,4- dioxo- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 1- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C2=C(C(C1=O)(O)C(F)(F)F)C(=O)CC(C2)(C)C

STK773092
Synonyms: 1- (furan- 2- ylcarbonyl)imidazolidin- 2- one
Smiles: O=C1NCCN1C(=O)c1ccco1

STK682068
Synonyms: ethyl3- [(furan- 2- ylcarbonyl)amino]- 3- (4- methoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)c1ccco1

STK773096
Synonyms: ethyl3- {[(4- chloro- 3,5- dimethylphenoxy)acetyl]amino}- 3- (4- methoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)COc1cc(C)c(c(c1)C)Cl

STK682072
Synonyms: 3- (3,4- dimethoxyphenyl)- 3- {[(2,5- dimethylphenoxy)acetyl]amino}propanoicacid
Smiles: COc1cc(ccc1OC)C(CC(=O)O)NC(=O)COc1cc(C)ccc1C

STK682073
Synonyms: 3- {[(4- chloro- 3,5- dimethylphenoxy)acetyl]amino}- 3- (3,4- dimethoxyphenyl)propanoicacid
Smiles: COc1cc(ccc1OC)C(CC(=O)O)NC(=O)COc1cc(C)c(c(c1)C)Cl

STK773100
Synonyms: 7- chloro- 6- fluoro- 3,3- bis(trifluoromethyl)- 2- azabicyclo[2.2.1]heptane
Smiles: FC1CC2C(C1NC2(C(F)(F)F)C(F)(F)F)Cl

STK773101
Synonyms: N- [2- (3,4- diethoxyphenyl)ethyl]- 2- (4H- 1,2,4- triazol- 3- yl)acetamide
Smiles: CCOc1cc(CCNC(=O)Cc2nnc[nH]2)ccc1OCC

STK682074
Synonyms: 3- (4- tert- butylphenyl)- 3- {[(phenylsulfanyl)acetyl]amino}propanoicacid
Smiles: O=C(NC(c1ccc(cc1)C(C)(C)C)CC(=O)O)CSc1ccccc1

STK682076
Synonyms: 3- (4- tert- butylphenyl)- 3- {[(4- fluorophenyl)acetyl]amino}propanoicacid
Smiles: O=C(NC(c1ccc(cc1)C(C)(C)C)CC(=O)O)Cc1ccc(cc1)F

STK682079
Synonyms: 3- (4- tert- butylphenyl)- 3- {[(3,4- dichlorophenyl)carbonyl]amino}propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)C(C)(C)C)NC(=O)c1ccc(c(c1)Cl)Cl

STK682080
Synonyms: 3- (4- tert- butylphenyl)- 3- {[(2- chlorophenoxy)acetyl]amino}propanoicacid
Smiles: O=C(NC(c1ccc(cc1)C(C)(C)C)CC(=O)O)COc1ccccc1Cl

STK682081
Synonyms: 3- (4- tert- butylphenyl)- 3- [(thiophen- 2- ylcarbonyl)amino]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)C(C)(C)C)NC(=O)c1cccs1

STK773102
Synonyms: ethyl3- [(benzylsulfonyl)amino]- 3- (4- ethoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OCC)NS(=O)(=O)Cc1ccccc1

STK773109
Synonyms: 1- (2- fluorophenyl)- 4- phenyl- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CCCC2=C1C(CC(=O)N2c1ccccc1F)c1ccccc1

STK773110
Synonyms: 1- (3,5- dichlorophenyl)- 7,7- dimethyl- 4- (thiophen- 2- yl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cccs1

STK773111
Synonyms: 1- (3,5- dichlorophenyl)- 7,7- dimethyl- 4- (thiophen- 3- yl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cscc1

STK682086
Synonyms: 1- (3- fluorophenyl)- 7,7- dimethyl- 4- (thiophen- 2- yl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1cccc(c1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cccs1

STK773113
Synonyms: 4- (2- methylphenyl)- 1- [4- (trifluoromethyl)phenyl]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CC(C2=C(N1c1ccc(cc1)C(F)(F)F)CCCC2=O)c1ccccc1C

STK773114
Synonyms: 4- (thiophen- 2- yl)- 1- [4- (trifluoromethyl)phenyl]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CC(c2cccs2)C2=C(N1c1ccc(cc1)C(F)(F)F)CCCC2=O

STK773116
Synonyms: 4- phenyl- 1- [3- (trifluoromethyl)phenyl]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CC(c2ccccc2)C2=C(N1c1cccc(c1)C(F)(F)F)CCCC2=O

STK773118
Synonyms: 7,7- dimethyl- 4- (thiophen- 2- yl)- 1- [2- (trifluoromethyl)phenyl]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CC(C)(C)CC2=C1C(CC(=O)N2c1ccccc1C(F)(F)F)c1cccs1

STK682087
Synonyms: 2- (1- {[2- (2,5- dimethyl- 1H- indol- 3- yl)ethyl]amino}propylidene)- 5- phenylcyclohexane- 1,3- dione
Smiles: CC/C(=C\1/C(=O)CC(CC1=O)c1ccccc1)/NCCc1c(C)[nH]c2c1cc(C)cc2

STK773121
Synonyms: 1- (4- fluorophenyl)- 4- (4- nitrophenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)CC(C2=C1CCCC2=O)c1ccc(cc1)[N+](=O)[O-]

STK682089
Synonyms: 3- (4- tert- butylphenyl)- 3- {[(4- tert- butylphenyl)carbonyl]amino}propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)C(C)(C)C)NC(=O)c1ccc(cc1)C(C)(C)C

STK682098
Synonyms: (3- chloropyrazolo[1,5- a]pyrimidin- 2- yl)[4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)piperazin- 1- yl]methanone
Smiles: O=C(c1nn2c(c1Cl)nccc2)N1CCN(CC1)C12CC3CC(C2)CC(C1)C3

STK682099
Synonyms: [9- (3,5- dichloro- 4- propoxyphenyl)- 3,3,6,6- tetramethyl- 1,8- dioxo- 2,3,4,5,6,7,8,9- octahydroacridin- 10(1H)- yl]aceticacid
Smiles: CCCOc1c(Cl)cc(cc1Cl)C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)CC(=O)O

STK682101
Synonyms: 5- methyl- 7- propyl- 6H- spiro[1,3- diazatricyclo[3.3.1.1~3,7~]decane- 2,3'- indole]- 2',6(1'H)- dione
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C13C(=O)Nc2c1cccc2)C

STK773132
Synonyms: 1- C- (6,6- dimethyl- 5,7- dinitro- 1,3- diazatricyclo[3.3.1.1~3,7~]dec- 2- yl)pentitol
Smiles: OCC(C(C(C(C1N2CC3(CN1CC(C2)(C3(C)C)[N+](=O)[O-])[N+](=O)[O-])O)O)O)O

STK682107
Synonyms: 5,7- dimethyl- 2- (thiophen- 2- yl)- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- ol
Smiles: OC1C2(C)CN3CC1(C)CN(C2)C3c1cccs1

STK773141
Synonyms: 5,7- dimethyl- 2- (4- methylphenyl)- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: O=C1C2(C)CN3CC1(C)CN(C2)C3c1ccc(cc1)C