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

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STK782915
Synonyms: 2'- (1,3- benzodioxol- 5- yl)- 5- fluoro- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: Fc1ccc2c(c1)C1(C(=O)N2)N2CCCC2C2C1C(=O)N(C2=O)c1ccc2c(c1)OCO2

STK782916
Synonyms: 5- chloro- 2'- (4- chlorophenyl)- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(Cl)cc2

STK687009
Synonyms: 3- methoxy- 5- nitrobenzoicacid
Smiles: COc1cc(cc(c1)C(=O)O)[N+](=O)[O-]

STK687010
Synonyms: 3- {5- [2- (3,5- di- tert- butyl- 4- hydroxyphenyl)- 2- oxoethyl]- 3- oxo- 3,5- dihydro[1,2,4]triazino[2,3- a]benzimidazol- 2- yl}propanoicacid
Smiles: OC(=O)CCc1nn2c(nc1=O)n(c1c2cccc1)CC(=O)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

STK687013
Synonyms: 13- ethyl- 5,11- bis(methylsulfonyl)- 5,6,11,12- tetrahydro- 6,12- epiminodibenzo[b,f][1,5]diazocine
Smiles: CCN1C2c3ccccc3N(C1c1c(N2S(=O)(=O)C)cccc1)S(=O)(=O)C

STK687016
Synonyms: N- (3,4,5,6- tetrahydro- 2H- azepin- 7- yl)glycine
Smiles: OC(=O)CNC1=NCCCCC1

STK782925
Synonyms: 7- ethyl- 1,3- dimethyl- 8- (quinolin- 8- yloxy)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(Oc2cccc3c2nccc3)nc2c1c(=O)n(c(=O)n2C)C

STK687047
Synonyms: 7- {[4- amino- 6- (dimethylamino)- 1,3,5- triazin- 2- yl]methyl}- 8- chloro- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Nc1nc(nc(n1)N(C)C)Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C

STK782937
Synonyms: 3- (2- chlorophenyl)- 6- (naphthalen- 2- yl)- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: O=C1C2C(C(=O)N1c1ccc3c(c1)cccc3)C1CC2C2C1ON=C2c1ccccc1Cl

STK782956
Synonyms: ethyl4- [3- (3,4- dimethoxyphenyl)- 5,7- dioxo- 3a,4,4a,5,7,7a,8,8a- octahydro- 6H- 4,8- methano[1,2]oxazolo[4,5- f]isoindol- 6- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C2C1C(=NO2)c1ccc(c(c1)OC)OC

STK687079
Synonyms: 2- [4- ({3- (ethoxycarbonyl)- 4- methyl- 5- [(2- methylphenyl)carbamoyl]thiophen- 2- yl}carbamothioyl)piperazin- 1- yl]- 8- ethyl- 5- oxo- 5,8- dihydropyrido[2,3- d]pyrimidine- 6- carboxylicacid
Smiles: CCOC(=O)c1c(NC(=S)N2CCN(CC2)c2ncc3c(n2)n(CC)cc(c3=O)C(=O)O)sc(c1C)C(=O)Nc1ccccc1C

STK782990
Synonyms: N- (4- fluorobenzyl)- 3- [(4- nitro- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1onc(n1)Cn1ncc(c1)[N+](=O)[O-]

STK782991
Synonyms: N- benzyl- 3- [(4- nitro- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCc1ccccc1

STK782992
Synonyms: methyl5- (2- oxo- 2,3- dihydro- 1H- thieno[3,4- d]imidazol- 4- yl)pentanoate
Smiles: COC(=O)CCCCc1scc2c1[nH]c(=O)[nH]2

STK782994
Synonyms: N- cyclohexyl- 2,3- dihydrofuro[3,4- b][1,4]dioxine- 5- carboxamide
Smiles: O=C(c1occ2c1OCCO2)NC1CCCCC1

STK782995
Synonyms: 2,3- dihydrofuro[3,4- b][1,4]dioxin- 5- yl[4- (4- fluorophenyl)piperazin- 1- yl]methanone
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)c1occ2c1OCCO2

STK687082
Synonyms: N- benzyl- 2- [(7- cyano- 3,4- dihydro- 2H- 1,4- ethano- 1,5- naphthyridin- 6- yl)sulfanyl]acetamide
Smiles: N#Cc1cc2N3CCC(c2nc1SCC(=O)NCc1ccccc1)CC3

STK782998
Synonyms: 2- {[4- methyl- 5- (2- methylpropyl)- 1H- imidazol- 2- yl]sulfanyl}- N- (1- phenylethyl)acetamide
Smiles: CC(Cc1[nH]c(nc1C)SCC(=O)NC(c1ccccc1)C)C

STK782999
Synonyms: (2- oxido- 1,2,5- oxadiazole- 3,4- diyl)bis(furan- 2- ylmethanone)
Smiles: [O-][n+]1onc(c1C(=O)c1ccco1)C(=O)c1ccco1

STK783000
Synonyms: N- [5- ({2- [(4- butoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 1,3,4- thiadiazol- 2- yl]- 3- (1H- tetrazol- 1- yl)propanamide
Smiles: CCCCOc1ccc(cc1)NC(=O)CSc1nnc(s1)NC(=O)CCn1cnnn1

STK783001
Synonyms: N- [5- ({2- [(4- bromophenyl)amino]- 2- oxoethyl}sulfanyl)- 1,3,4- thiadiazol- 2- yl]- 3- (1H- tetrazol- 1- yl)propanamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(s1)NC(=O)CCn1cnnn1

STK687083
Synonyms: 2- {1- [(1H- benzimidazol- 2- ylmethyl)amino]ethylidene}- 5,5- dimethylcyclohexane- 1,3- dione
Smiles: CC(=C1C(=O)CC(CC1=O)(C)C)NCc1nc2c([nH]1)cccc2

STK783002
Synonyms: 4- [(2- hydroxyphenyl)amino]- 6- methyl- 3- propanoyl- 2H- pyran- 2- one
Smiles: CCC(=O)c1c(cc(oc1=O)C)Nc1ccccc1O

STK687085
Synonyms: 4,5- dichloro- N- cyclohexyl- 1- ethyl- 1H- pyrazole- 3- carboxamide
Smiles: CCn1nc(c(c1Cl)Cl)C(=O)NC1CCCCC1

STK783009
Synonyms: 1,6- diamino- 4- (1- ethyl- 3- methyl- 1H- pyrazol- 4- yl)- 2- oxo- 1,2- dihydropyridine- 3,5- dicarbonitrile
Smiles: CCn1nc(c(c1)c1c(C#N)c(N)n(c(=O)c1C#N)N)C

STK783011
Synonyms: 3,4- dimethoxy- N- {4- [3- phenyl- 5- (trifluoromethyl)- 1H- pyrazol- 1- yl]phenyl}benzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1ccc(cc1)n1nc(cc1C(F)(F)F)c1ccccc1

STK687086
Synonyms: ethyl4- [5- (4- chlorophenyl)- 8- oxo- 6- (pyridin- 2- yl)- 2,3,6,8- tetrahydropyrrolo[3,4- e][1,4]diazepin- 7(1H)- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C2=C(C1c1ccccn1)C(=NCCN2)c1ccc(cc1)Cl

STK783013
Synonyms: 2- {1- [4- (1H- imidazol- 1- yl)phenyl]ethyl}- 5- methyl- 3a,4,7,7a- tetrahydro- 1H- isoindole- 1,3(2H)- dione
Smiles: CC1=CCC2C(C1)C(=O)N(C2=O)C(c1ccc(cc1)n1ccnc1)C

STK783016
Synonyms: 2,3- dicyano- N- (3,4- difluorophenyl)- 8,9,9- trimethyl- 7,8- dihydro- 5,8- methanoquinoxaline- 5(6H)- carboxamide
Smiles: N#Cc1nc2c(nc1C#N)C1(C(C2(CC1)C(=O)Nc1ccc(c(c1)F)F)(C)C)C

STK783017
Synonyms: N- [3- (trifluoromethyl)phenyl]- 1H- benzimidazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)[nH]cn2)Nc1cccc(c1)C(F)(F)F

STK687088
Synonyms: [5- amino- 2- (propan- 2- yl)- 2,3- dihydro- 4H- imidazol- 4- ylidene]propanedinitrile
Smiles: N#CC(=C1NC(N=C1N)C(C)C)C#N

STK783019
Synonyms: 4- [4- (1H- tetrazol- 1- yl)phenyl]- 1,3- thiazol- 2- amine
Smiles: Nc1scc(n1)c1ccc(cc1)n1cnnn1

STK783021
Synonyms: 2- {[(8- methylimidazo[1,2- a]pyridin- 2- yl)methoxy]methyl}- 1,3- benzothiazole
Smiles: Cc1cccn2c1nc(c2)COCc1nc2c(s1)cccc2

STK783022
Synonyms: 3- [5- methyl- 2- (methylsulfinyl)thiophen- 3- yl]- 5- phenyl- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: O=C1N(c2ccccc2)C(=O)C2C1C(=NO2)c1cc(sc1S(=O)C)C

STK783023
Synonyms: 3- [5- methyl- 2- (methylsulfanyl)thiophen- 3- yl]- 5- phenyl- 4,5- dihydro- 1,2- oxazole
Smiles: CSc1sc(cc1C1=NOC(C1)c1ccccc1)C

STK783024
Synonyms: (6- fluoro- 2- methyl- 3,4- dihydroquinolin- 1(2H)- yl)(quinoxalin- 6- yl)methanone
Smiles: Fc1ccc2c(c1)CCC(N2C(=O)c1ccc2c(c1)nccn2)C

STK687090
Synonyms: 6- cyclohexyl- 1,4,5,7- tetramethyl- 6H- pyrrolo[3,4- d]pyridazine
Smiles: Cc1n(C2CCCCC2)c(c2c1c(C)nnc2C)C

STK783026
Synonyms: 2,3,3,6,6,7- hexamethyl- 3,6- dihydropyrrolo[3,2- g]indole
Smiles: CC1=Nc2c(C1(C)C)ccc1c2N=C(C1(C)C)C

STK783028
Synonyms: methyl5'- amino- 6'- cyano- 1- (2- fluorobenzyl)- 2'- methyl- 2- oxo- 1,2- dihydrospiro[indole- 3,7'- thieno[3,2- b]pyran]- 3'- carboxylate
Smiles: COC(=O)c1c(C)sc2c1OC(=C(C12c2ccccc2N(C1=O)Cc1ccccc1F)C#N)N

STK783031
Synonyms: 4- [3- (trifluoromethyl)phenyl]- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: O=C1CC(c2cccc(c2)C(F)(F)F)c2c(O1)c1ccccc1[nH]c2=O

STK783032
Synonyms: 4- (4- bromothiophen- 2- yl)- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: O=C1CC(c2scc(c2)Br)c2c(O1)c1ccccc1[nH]c2=O

STK783036
Synonyms: methyl5'- amino- 6'- cyano- 1- (3- fluorobenzyl)- 2'- methyl- 2- oxo- 1,2- dihydrospiro[indole- 3,7'- thieno[3,2- b]pyran]- 3'- carboxylate
Smiles: COC(=O)c1c(C)sc2c1OC(=C(C12c2ccccc2N(C1=O)Cc1cccc(c1)F)C#N)N

STK783037
Synonyms: ethyl5'- amino- 6'- cyano- 1- (3- fluorobenzyl)- 2'- methyl- 2- oxo- 1,2- dihydrospiro[indole- 3,7'- thieno[3,2- b]pyran]- 3'- carboxylate
Smiles: CCOC(=O)c1c(C)sc2c1OC(=C(C12c2ccccc2N(C1=O)Cc1cccc(c1)F)C#N)N

STK783046
Synonyms: 4- {4- [(4- fluorobenzyl)oxy]- 3- methoxyphenyl}- 6- methyl- 3,4- dihydropyrido[3',2':5,6]pyrimido[1,2- a]benzimidazole- 2,5(1H,6H)- dione
Smiles: COc1cc(ccc1OCc1ccc(cc1)F)C1CC(=O)Nc2c1c(=O)n(C)c1n2c2ccccc2n1

STK783049
Synonyms: ethyl5- cyano- 4- (4- methoxyphenyl)- 2- methyl- 6- (1H- pyrrol- 1- yl)- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1ccc(cc1)OC)C#N)n1cccc1

STK687111
Synonyms: 1'- (3,5- dichlorophenyl)- 2,5'- dioxo- 1- (prop- 2- yn- 1- yl)- 2'- (1H- pyrrol- 1- yl)- 1,2,5',6',7',8'- hexahydro- 1'H- spiro[indole- 3,4'- quinoline]- 3'- carbonitrile
Smiles: C#CCN1c2ccccc2C2(C1=O)C(=C(n1cccc1)N(C1=C2C(=O)CCC1)c1cc(Cl)cc(c1)Cl)C#N

STK687114
Synonyms: 1'- (2- methyl- 5- nitrophenyl)- 2,5'- dioxo- 1- (prop- 2- yn- 1- yl)- 2'- (1H- pyrrol- 1- yl)- 1,2,5',6',7',8'- hexahydro- 1'H- spiro[indole- 3,4'- quinoline]- 3'- carbonitrile
Smiles: C#CCN1c2ccccc2C2(C1=O)C(=C(n1cccc1)N(C1=C2C(=O)CCC1)c1cc(ccc1C)[N+](=O)[O-])C#N

STK783067
Synonyms: N- {4- [4- (2- amino- 1,3- thiazol- 4- yl)- 5- methyl- 1H- 1,2,3- triazol- 1- yl]- 1,2,5- oxadiazol- 3- yl}acetamide
Smiles: CC(=O)Nc1nonc1n1nnc(c1C)c1csc(n1)N

STK783068
Synonyms: 3- [5- (4- ethoxyphenyl)- 1H- 1,2,3- triazol- 1- yl]- 4- (1H- pyrrol- 1- yl)- 1,2,5- oxadiazole
Smiles: CCOc1ccc(cc1)c1cnnn1c1nonc1n1cccc1

STK783069
Synonyms: 2- {[4- methyl- 5- (2- methylpropyl)- 1H- imidazol- 2- yl]sulfanyl}- N- [5- (2- methylpropyl)- 1,3,4- thiadiazol- 2- yl]acetamide
Smiles: O=C(Nc1nnc(s1)CC(C)C)CSc1[nH]c(c(n1)C)CC(C)C

STK783070
Synonyms: 2- ({[4- methyl- 5- (2- methylpropyl)- 1H- imidazol- 2- yl]sulfanyl}methyl)quinazolin- 4(3H)- one
Smiles: CC(Cc1[nH]c(nc1C)SCc1nc2ccccc2c(=O)[nH]1)C

STK687117
Synonyms: 8- methyl- 8- azaspiro[bicyclo[3.2.1]octane- 3,1'- cyclopropane]- 2',2',3',3'- tetracarbonitrile
Smiles: CN1C2CCC1CC1(C2)C(C1(C#N)C#N)(C#N)C#N

STK687119
Synonyms: 6- benzyl- 6- azaspiro[2.5]octane- 1,1,2,2- tetracarbonitrile
Smiles: N#CC1(C#N)C(C21CCN(CC2)Cc1ccccc1)(C#N)C#N

STK783076
Synonyms: 1'- methyl- 2'- oxo- 1',2'- dihydrospiro[cyclopropane- 1,3'- indole]- 2,2,3,3- tetracarbonitrile
Smiles: N#CC1(C#N)C2(C1(C#N)C#N)c1ccccc1N(C2=O)C

STK783077
Synonyms: 1'- methyl- 2,2',4- trioxo- 1',2'- dihydrospiro[3- azabicyclo[3.1.0]hexane- 6,3'- indole]- 1,5- dicarbonitrile
Smiles: N#CC12C(=O)NC(=O)C2(C21c1ccccc1N(C2=O)C)C#N

STK783078
Synonyms: 1- (6- methylpyridin- 2- yl)- 6- [2- (morpholin- 4- yl)ethyl]- 2- thioxo- 2,3,5,6,7,8- hexahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: Cc1cccc(n1)n1c(=S)[nH]c(=O)c2c1NCN(C2)CCN1CCOCC1

STK783079
Synonyms: N- cyclohexyl- 3- [(phenylsulfonyl)methyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)CS(=O)(=O)c1ccccc1)NC1CCCCC1

STK687125
Synonyms: 6- methyl- 5- ({4- [2- (pyridin- 4- yl)ethyl]piperazin- 1- yl}sulfonyl)pyrimidine- 2,4(1H,3H)- dione
Smiles: O=c1[nH]c(C)c(c(=O)[nH]1)S(=O)(=O)N1CCN(CC1)CCc1ccncc1

STK783083
Synonyms: 6- (4- methoxybenzyl)- 1- (2- phenylethyl)- 2- thioxo- 2,3,5,6,7,8- hexahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: COc1ccc(cc1)CN1CNc2c(C1)c(=O)[nH]c(=S)n2CCc1ccccc1

STK687128
Synonyms: N- [4- (1H- pyrrol- 1- yl)benzyl]pyrazine- 2- carboxamide
Smiles: O=C(c1cnccn1)NCc1ccc(cc1)n1cccc1

STK783086
Synonyms: 2- (naphthalen- 1- yloxy)- N- [4- (1H- pyrrol- 1- yl)benzyl]acetamide
Smiles: O=C(COc1cccc2c1cccc2)NCc1ccc(cc1)n1cccc1

STK687129
Synonyms: 2- (4- bromo- 5- methyl- 3- nitro- 1H- pyrazol- 1- yl)- N- (5- chloropyridin- 2- yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Br)[N+](=O)[O-])Nc1ccc(cn1)Cl

STK783088
Synonyms: 3- (3,4- dimethoxyphenyl)- N- [4- (1H- pyrrol- 1- yl)benzyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NCc1ccc(cc1)n1cccc1

STK783089
Synonyms: N- (1- benzyl- 3- methyl- 1H- pyrazol- 5- yl)- 4- fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1cc(nn1Cc1ccccc1)C

STK783092
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)- 2- oxo- 2H- chromene- 3- carboxamide
Smiles: O=C(c1cc2ccccc2oc1=O)Nc1cccc2c1non2

STK687130
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- (4- methoxybenzyl)- 1,2,4- oxadiazole
Smiles: COc1ccc(cc1)Cc1onc(n1)c1ccc2c(c1)OCO2

STK687131
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- [(4- fluorophenoxy)methyl]- 1,2,4- oxadiazole
Smiles: Fc1ccc(cc1)OCc1onc(n1)c1ccc2c(c1)OCO2

STK783097
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- [(2- chlorophenoxy)methyl]- 1,2,4- oxadiazole
Smiles: Clc1ccccc1OCc1onc(n1)c1ccc2c(c1)OCO2

STK783098
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- (4- fluorophenyl)- 1,2,4- oxadiazole
Smiles: Fc1ccc(cc1)c1onc(n1)c1ccc2c(c1)OCO2

STK783099
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- (2- fluorophenyl)- 1,2,4- oxadiazole
Smiles: Fc1ccccc1c1onc(n1)c1ccc2c(c1)OCO2

STK783101
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- [(3- chlorophenoxy)methyl]- 1,2,4- oxadiazole
Smiles: Clc1cccc(c1)OCc1onc(n1)c1ccc2c(c1)OCO2

STK783102
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- (5- bromofuran- 2- yl)- 1,2,4- oxadiazole
Smiles: Brc1ccc(o1)c1onc(n1)c1ccc2c(c1)OCO2

STK783103
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- (thiophen- 2- yl)- 1,2,4- oxadiazole
Smiles: c1csc(c1)c1onc(n1)c1ccc2c(c1)OCO2

STK783104
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- (furan- 2- yl)- 1,2,4- oxadiazole
Smiles: c1coc(c1)c1onc(n1)c1ccc2c(c1)OCO2

STK783105
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- (phenoxymethyl)- 1,2,4- oxadiazole
Smiles: c1ccc(cc1)OCc1onc(n1)c1ccc2c(c1)OCO2

STK783106
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- (2- phenylethyl)- 1,2,4- oxadiazole
Smiles: c1ccc(cc1)CCc1onc(n1)c1ccc2c(c1)OCO2

STK687134
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- (2- phenylcyclopropyl)- 1,2,4- oxadiazole
Smiles: c1ccc(cc1)C1CC1c1onc(n1)c1ccc2c(c1)OCO2

STK687138
Synonyms: 5- [(1,2,2,6,6- pentamethylpiperidin- 4- yl)carbamoyl]- 1H- imidazole- 4- carboxylicacid
Smiles: CN1C(C)(C)CC(CC1(C)C)NC(=O)c1[nH]cnc1C(=O)O

STK783112
Synonyms: 6- benzyl- 5- hydroxy- 7- methyl[1,3]thiazolo[4,5- b]pyridin- 2(3H)- one
Smiles: Oc1nc2[nH]c(=O)sc2c(c1Cc1ccccc1)C

STK687140
Synonyms: 6- benzyl- 7- methyl- 2- oxo- 2,3- dihydro[1,3]thiazolo[4,5- b]pyridin- 5- ylacetate
Smiles: CC(=O)Oc1nc2[nH]c(=O)sc2c(c1Cc1ccccc1)C

STK783116
Synonyms: dimethyl5- {[(1,5- dimethyl- 1H- pyrazol- 4- yl)carbonyl]amino}benzene- 1,3- dicarboxylate
Smiles: COC(=O)c1cc(cc(c1)C(=O)OC)NC(=O)c1cnn(c1C)C

STK783119
Synonyms: 1,5- dimethyl- N- [4- (1,2- oxazol- 5- yl)phenyl]- 1H- pyrazole- 4- carboxamide
Smiles: O=C(c1cnn(c1C)C)Nc1ccc(cc1)c1ccno1

STK783121
Synonyms: 4- cyclopropyl- 1,3- dimethyl- N- [4- (1,2- oxazol- 5- yl)phenyl]- 1H- pyrazolo[3,4- b]pyridine- 6- carboxamide
Smiles: O=C(c1cc(C2CC2)c2c(n1)n(C)nc2C)Nc1ccc(cc1)c1ccno1

STK783122
Synonyms: N- (4- fluorophenyl)quinoxaline- 2- carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1cnc2c(n1)cccc2

STK783125
Synonyms: N- (2- fluorophenyl)quinoxaline- 2- carboxamide
Smiles: O=C(c1cnc2c(n1)cccc2)Nc1ccccc1F

STK687141
Synonyms: 2- [4- (3- chlorophenyl)piperazin- 1- yl]- N- [6- (methylsulfonyl)- 1,3- benzothiazol- 2- yl]acetamide
Smiles: O=C(Nc1nc2c(s1)cc(cc2)S(=O)(=O)C)CN1CCN(CC1)c1cccc(c1)Cl

STK783126
Synonyms: (5E)- 3- (4- amino- 1,2,5- oxadiazol- 3- yl)- 2- imino- 5- {[3- (2- methylpropyl)- 1- phenyl- 1H- pyrazol- 4- yl]methylidene}- 1,3- thiazolidin- 4- one
Smiles: CC(Cc1nn(cc1/C=C\1/SC(=N)N(C1=O)c1nonc1N)c1ccccc1)C

STK783128
Synonyms: 2- (4- bromo- 5- methyl- 3- nitro- 1H- pyrazol- 1- yl)- 1- (4- chloro- 1H- pyrazol- 1- yl)ethanone
Smiles: Clc1cnn(c1)C(=O)Cn1nc(c(c1C)Br)[N+](=O)[O-]

STK783133
Synonyms: N- (4- methoxyphenyl)- 1,4,5,6- tetrahydrocyclopenta[c]pyrazole- 3- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1n[nH]c2c1CCC2

STK783134
Synonyms: 3- [(phenylsulfonyl)methyl]- N- (tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)CS(=O)(=O)c1ccccc1)NCC12CC3CC(C2)CC(C1)C3

STK783135
Synonyms: 2- (thiophen- 2- yl)- N- [2- (trifluoromethyl)- 1H- benzimidazol- 4- yl]acetamide
Smiles: O=C(Nc1cccc2c1nc([nH]2)C(F)(F)F)Cc1cccs1

STK783136
Synonyms: N- (3,5- dimethoxybenzyl)- 2- (trifluoromethyl)- 1H- benzimidazol- 7- amine
Smiles: COc1cc(CNc2cccc3c2[nH]c(n3)C(F)(F)F)cc(c1)OC

STK783137
Synonyms: N- (4- methoxybenzyl)- 2- methyl- 1H- benzimidazol- 7- amine
Smiles: COc1ccc(cc1)CNc1cccc2c1[nH]c(n2)C

STK783139
Synonyms: 4- fluoro- N- [2- (pyridin- 4- yl)ethyl]benzamide
Smiles: Fc1ccc(cc1)C(=O)NCCc1ccncc1

STK783140
Synonyms: 2- amino- 1- (3- chlorophenyl)- 5- oxo- 4- [4- (1H- 1,2,4- triazol- 1- ylmethyl)thiophen- 2- yl]- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(c2cccc(c2)Cl)C2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CCC2

STK783141
Synonyms: 2- amino- 1- (4- chlorophenyl)- 7,7- dimethyl- 5- oxo- 4- [4- (1H- 1,2,4- triazol- 1- ylmethyl)thiophen- 2- yl]- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(cc2)Cl)C2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CC(C2)(C)C

STK687147
Synonyms: (3- amino- 8- methyl- 1,4- diazaspiro[4.5]dec- 3- en- 2- ylidene)propanedinitrile
Smiles: N#CC(=C1NC2(N=C1N)CCC(CC2)C)C#N

STK783150
Synonyms: 2- (4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- [4- (1H- pyrrol- 1- yl)benzyl]acetamide
Smiles: O=C(Cn1nc(c(c1C)Br)C)NCc1ccc(cc1)n1cccc1

STK783155
Synonyms: N- [4- (1H- pyrrol- 1- yl)benzyl]pyridine- 4- carboxamide
Smiles: O=C(c1ccncc1)NCc1ccc(cc1)n1cccc1

STK687150
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- [4- (1H- pyrrol- 1- yl)benzyl]acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCc1ccc(cc1)n1cccc1

STK687151
Synonyms: 2- methyl- N- [4- (1H- pyrrol- 1- yl)benzyl]quinoline- 4- carboxamide
Smiles: Cc1nc2ccccc2c(c1)C(=O)NCc1ccc(cc1)n1cccc1

STK783158
Synonyms: N- (1- benzyl- 3- methyl- 1H- pyrazol- 5- yl)- 2- (4- fluorophenoxy)acetamide
Smiles: O=C(Nc1cc(nn1Cc1ccccc1)C)COc1ccc(cc1)F

STK783159
Synonyms: N- (1- benzyl- 3- methyl- 1H- pyrazol- 5- yl)pyridine- 3- carboxamide
Smiles: Cc1cc(n(n1)Cc1ccccc1)NC(=O)c1cccnc1

STK783163
Synonyms: 3- [4- (1H- pyrrol- 1- yl)phenyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: NC(=O)c1onc(n1)c1ccc(cc1)n1cccc1

STK783171
Synonyms: 3- (5- bromofuran- 2- yl)- N- (2- fluorobenzyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Brc1ccc(o1)c1noc(n1)C(=O)NCc1ccccc1F

STK783174
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 3- {[(4- chlorophenyl)sulfonyl]methyl}- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1noc(n1)C(=O)NCc1ccc2c(c1)OCO2

STK783176
Synonyms: 3- {[(4- chlorophenyl)sulfonyl]methyl}- N- (pyridin- 3- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1noc(n1)C(=O)NCc1cccnc1

STK783177
Synonyms: 3- {[(4- chlorophenyl)sulfonyl]methyl}- N- [2- (2- methoxyphenyl)ethyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: COc1ccccc1CCNC(=O)c1onc(n1)CS(=O)(=O)c1ccc(cc1)Cl

STK783179
Synonyms: 2- [(5- methyl- 1,3,4- thiadiazol- 2- yl)amino]- 2- oxoethylS- benzyl- N- (phenylcarbonyl)cysteinate
Smiles: O=C(Nc1nnc(s1)C)COC(=O)C(NC(=O)c1ccccc1)CSCc1ccccc1

STK783180
Synonyms: 5- chloro- 7- methyl[1,2,4]triazolo[4,3- a]pyrimidine
Smiles: Cc1cc(Cl)n2c(n1)nnc2

STK687156
Synonyms: ethyl6- bromo- 4- [(dimethylamino)methyl]- 5- hydroxy- 2- [(4- methoxyphenoxy)methyl]- 1- methyl- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c(COc2ccc(cc2)OC)n(c2c1c(CN(C)C)c(O)c(c2)Br)C

STK783182
Synonyms: 2- [3- ethoxy- 5- iodo- 4- (prop- 2- yn- 1- yloxy)phenyl]- 2,3- dihydro- 4H- 1,3- benzoxazin- 4- one
Smiles: C#CCOc1c(I)cc(cc1OCC)C1NC(=O)c2c(O1)cccc2

STK687158
Synonyms: 7- (ethoxycarbonyl)- 2,3- dihydrofuro[3,4- b][1,4]dioxine- 5- carboxylicacid
Smiles: CCOC(=O)c1oc(c2c1OCCO2)C(=O)O

STK687164
Synonyms: 6- chloro- 1,3- benzodioxole- 5- carbonitrile
Smiles: N#Cc1cc2OCOc2cc1Cl

STK687168
Synonyms: 2- {[5- (4- methylphenyl)- 2H- tetrazol- 2- yl]methyl}quinazolin- 4(1H)- one
Smiles: Cc1ccc(cc1)c1nnn(n1)Cc1nc(=O)c2c([nH]1)cccc2

STK687169
Synonyms: 4- cyclopropyl- N- (4- fluorobenzyl)- 1,3- dimethyl- 1H- pyrazolo[3,4- b]pyridine- 6- carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1cc(C2CC2)c2c(n1)n(C)nc2C

STK687170
Synonyms: methyl4- {[6,7- dichloro- 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)quinoxalin- 2- yl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)Nc1nc2cc(Cl)c(cc2nc1n1nc(cc1C)C)Cl

STK687172
Synonyms: Nalpha- acetyl- N- (furan- 2- ylmethyl)tryptophanamide
Smiles: CC(=O)NC(C(=O)NCc1ccco1)Cc1c[nH]c2c1cccc2

STK783196
Synonyms: N- [4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- 1,2,5- oxadiazol- 3- yl]benzamide
Smiles: O=C(c1ccccc1)Nc1nonc1N1C(=O)c2c(C1=O)cccc2

STK783198
Synonyms: 5,6- dimethyl- 3- (pyridin- 4- yl)- 1,2,4- triazine
Smiles: Cc1nnc(nc1C)c1ccncc1

STK783199
Synonyms: 3- methoxy- 1,2- benzothiazol- 5- amine
Smiles: COc1nsc2c1cc(N)cc2

STK783201
Synonyms: methyl5- amino- 1- (2- methoxy- 5- methylphenyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: COC(=O)c1nnn(c1N)c1cc(C)ccc1OC

STK783203
Synonyms: 1- (3- methylphenyl)- 4- phenyl- 1H- 1,2,3- triazol- 5- amine
Smiles: Cc1cccc(c1)n1nnc(c1N)c1ccccc1

STK783204
Synonyms: 2- {[5- (4- hydroxybenzyl)- 4- methyl- 1H- imidazol- 2- yl]sulfanyl}- N- (5- methyl- 1,3,4- thiadiazol- 2- yl)acetamide
Smiles: O=C(Nc1nnc(s1)C)CSc1nc(c([nH]1)Cc1ccc(cc1)O)C

STK783209
Synonyms: N- (3- methoxyphenyl)- 5- (4- nitro- 1H- pyrazol- 5- yl)- 4H- 1,2,4- triazol- 3- amine
Smiles: COc1cccc(c1)Nc1nnc([nH]1)c1[nH]ncc1[N+](=O)[O-]

STK783210
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5- (4- nitro- 1H- pyrazol- 5- yl)- 4H- 1,2,4- triazol- 3- amine
Smiles: [O-][N+](=O)c1cn[nH]c1c1nnc([nH]1)Nc1ccc2c(c1)OCCO2

STK687173
Synonyms: 3- amino- 7- fluoro- 6- (4- methylpiperazin- 1- yl)quinoxaline- 2- carbonitrile
Smiles: CN1CCN(CC1)c1cc2nc(N)c(nc2cc1F)C#N

STK783212
Synonyms: 1- (4- chlorophenyl)- 7,7- dimethyl- N- (3- methylpent- 1- yn- 3- yl)- 2,5- dioxo- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: CCC(NC(=O)c1cc2C(=O)CC(Cc2n(c1=O)c1ccc(cc1)Cl)(C)C)(C#C)C

STK687174
Synonyms: {[6- cyclopentyl- 1- (furan- 2- ylmethyl)- 4- oxo- 1,4,5,6,7,8- hexahydropyrimido[4,5- d]pyrimidin- 2- yl]sulfanyl}acetonitrile
Smiles: N#CCSc1nc(=O)c2c(n1Cc1ccco1)NCN(C2)C1CCCC1

STK783216
Synonyms: 2- oxo- N- [2- (4- sulfamoylphenyl)ethyl]- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: O=C(c1cc2CCCCc2[nH]c1=O)NCCc1ccc(cc1)S(=O)(=O)N

STK687178
Synonyms: ethyl4- [(1- hydroxypropan- 2- yl)amino]- 8- methoxyquinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1NC(CO)C)cccc2OC

STK687179
Synonyms: ethyl8- methoxy- 4- (piperazin- 1- yl)quinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1N1CCNCC1)cccc2OC

STK783218
Synonyms: ethyl4- (cyclopropylamino)- 6,7- difluoroquinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1NC1CC1)cc(c(c2)F)F

STK687181
Synonyms: 4- methoxy- 7- oxo- 7,13- dihydrobenzimidazo[1,2- b]benzo[f][2,7]naphthyridine- 14- carbonitrile
Smiles: COc1cccc2c1ncc1c2c(C#N)c2n(c1=O)c1c([nH]2)cccc1

STK783219
Synonyms: (1R,2R,5S)- 2- (3- {[2- (2,4- dichlorobenzyl)- 2H- tetrazol- 5- yl]methyl}- 4- methyl- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl)- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@H]([C@H]2O[C@@H]1OC2)n1nc(n(c1=S)C)Cc1nnn(n1)Cc1ccc(cc1Cl)Cl

STK783222
Synonyms: 6,7- dichloro- 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (pyridin- 4- ylmethyl)quinoxalin- 2- amine
Smiles: Cc1nn(c(c1)C)c1nc2cc(Cl)c(cc2nc1NCc1ccncc1)Cl

STK687184
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 3- (5- bromofuran- 2- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Brc1ccc(o1)c1noc(n1)C(=O)NCc1ccc2c(c1)OCO2

STK783224
Synonyms: 3- (5- bromofuran- 2- yl)- N- (pyridin- 3- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Brc1ccc(o1)c1noc(n1)C(=O)NCc1cccnc1

STK687185
Synonyms: 3- (5- bromofuran- 2- yl)- N- (pyridin- 4- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Brc1ccc(o1)c1noc(n1)C(=O)NCc1ccncc1

STK783225
Synonyms: 3- (5- bromofuran- 2- yl)- N- [2- (2- methoxyphenyl)ethyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: COc1ccccc1CCNC(=O)c1onc(n1)c1ccc(o1)Br

STK783226
Synonyms: 3- (5- bromofuran- 2- yl)- N- (3- fluorobenzyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Fc1cccc(c1)CNC(=O)c1onc(n1)c1ccc(o1)Br

STK783227
Synonyms: 3- {[(4- chlorophenyl)sulfonyl]methyl}- N- (pyridin- 4- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1noc(n1)C(=O)NCc1ccncc1

STK783228
Synonyms: 3- {[(4- chlorophenyl)sulfonyl]methyl}- N- (2- fluorobenzyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1noc(n1)C(=O)NCc1ccccc1F

STK783229
Synonyms: 3- {[(4- chlorophenyl)sulfonyl]methyl}- N- (3- fluorobenzyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1noc(n1)C(=O)NCc1cccc(c1)F

STK687186
Synonyms: 6- (4- methoxyphenyl)- 7- methyl- 7H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine
Smiles: COc1ccc(cc1)C1=Nn2cnnc2SC1C

STK783230
Synonyms: 2- amino- 3- [(4- chlorophenyl)carbonyl]indolizine- 1- carboxamide
Smiles: Clc1ccc(cc1)C(=O)c1c(N)c(c2n1cccc2)C(=O)N

STK687187
Synonyms: 6- tert- butyl[1,2,4]triazolo[4,3- b][1,2,4]triazin- 7(8H)- one
Smiles: O=c1[nH]c2nncn2nc1C(C)(C)C

STK783232
Synonyms: 5- [2- (3,5- di- tert- butyl- 4- hydroxyphenyl)- 2- oxoethyl]- 2- methyl[1,2,4]triazino[2,3- a]benzimidazol- 3(5H)- one
Smiles: O=C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)Cn1c2nc(=O)c(nn2c2c1cccc2)C

STK783234
Synonyms: 10- (furan- 2- ylmethyl)- 11- oxo- 10,11- dihydrodibenzo[b,f][1,4]thiazepine- 7,8- dicarbonitrile
Smiles: N#Cc1cc2c(cc1C#N)Sc1c(C(=O)N2Cc2ccco2)cccc1

STK687189
Synonyms: 1- [2- methoxy- 5- (methylsulfanyl)thiophen- 3- yl]propan- 2- amine
Smiles: COc1sc(cc1CC(N)C)SC

STK783235
Synonyms: (Z)- N- hydroxy- 1- [2- methoxy- 5- (methylsulfanyl)thiophen- 3- yl]methanimine
Smiles: O/N=C\c1cc(sc1OC)SC

STK783237
Synonyms: 5- methoxythieno[3,2- d][1,2]thiazole
Smiles: COc1cc2c(s1)snc2

STK687190
Synonyms: 2- methoxy- 3,5- bis(methylsulfonyl)thiophene
Smiles: COc1sc(cc1S(=O)(=O)C)S(=O)(=O)C

STK783241
Synonyms: methyl1- (3- chlorobenzyl)- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1ccn(n1)Cc1cccc(c1)Cl

STK783242
Synonyms: (1R,2R,5S)- 2- [3- (4- amino- 1,2,5- oxadiazol- 3- yl)- 4- phenyl- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl]- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@H]([C@H]2O[C@@H]1OC2)n1nc(n(c1=S)c1ccccc1)c1nonc1N

STK687193
Synonyms: 6- [4- (3,5- dichlorophenyl)- 5- sulfanyl- 4H- 1,2,4- triazol- 3- yl]pyridazin- 3(2H)- one
Smiles: Clc1cc(Cl)cc(c1)n1c(S)nnc1c1ccc(=O)[nH]n1

STK783244
Synonyms: 6- [4- (3- chloro- 4- fluorophenyl)- 5- sulfanyl- 4H- 1,2,4- triazol- 3- yl]pyridazin- 3(2H)- one
Smiles: O=c1ccc(n[nH]1)c1nnc(n1c1ccc(c(c1)Cl)F)S

STK783245
Synonyms: 6- {4- [2- chloro- 5- (trifluoromethyl)phenyl]- 5- sulfanyl- 4H- 1,2,4- triazol- 3- yl}pyridazin- 3(2H)- one
Smiles: Clc1ccc(cc1n1c(S)nnc1c1ccc(=O)[nH]n1)C(F)(F)F

STK783246
Synonyms: 2- [3- (4- chlorophenyl)- 1H- pyrazol- 5- yl]- 1,3,4- oxadiazole
Smiles: Clc1ccc(cc1)c1cc([nH]n1)c1ocnn1

STK783248
Synonyms: N- (3- chloro- 4- fluorophenyl)- 5- (pyrazin- 2- yl)- 1,3,4- thiadiazol- 2- amine
Smiles: Fc1ccc(cc1Cl)Nc1nnc(s1)c1cnccn1

STK687195
Synonyms: 3- hydroxy- 3- [2- (4- methoxyphenyl)- 2- oxoethyl]- 1- [3- (trifluoromethyl)benzyl]- 1,3- dihydro- 2H- indol- 2- one
Smiles: COc1ccc(cc1)C(=O)CC1(O)c2ccccc2N(C1=O)Cc1cccc(c1)C(F)(F)F

STK687196
Synonyms: 4- {[4,5- dimethoxy- 2- (1H- tetrazol- 1- yl)phenyl]sulfonyl}morpholine
Smiles: COc1cc(c(cc1OC)n1cnnn1)S(=O)(=O)N1CCOCC1

STK687197
Synonyms: 3- amino- 7- fluoro- 6- (morpholin- 4- yl)quinoxaline- 2- carboxamide1,4- dioxide
Smiles: Fc1cc2c(cc1N1CCOCC1)[n+]([O-])c(c([n+]2[O-])C(=O)N)N

STK687198
Synonyms: 3- amino- 7- fluoro- 6- (4- methylpiperazin- 1- yl)quinoxaline- 2- carboxamide1,4- dioxide
Smiles: CN1CCN(CC1)c1cc2[n+]([O-])c(N)c([n+](c2cc1F)[O-])C(=O)N

STK687201
Synonyms: 3- amino- 7- fluoro- 6- (pyrrolidin- 1- yl)quinoxaline- 2- carboxamide1,4- dioxide
Smiles: Fc1cc2c(cc1N1CCCC1)[n+]([O-])c(c([n+]2[O-])C(=O)N)N

STK687204
Synonyms: 4- methoxy- 8,13- dihydro- 7H- quino[4,3- b][1,5]benzodiazepin- 7- one
Smiles: COc1cccc2c1ncc1c2[nH]c2ccccc2[nH]c1=O

STK783252
Synonyms: 2- amino- 4- (1- ethyl- 1H- pyrazol- 4- yl)- 6- methoxypyridine- 3,5- dicarbonitrile
Smiles: CCn1ncc(c1)c1c(C#N)c(N)nc(c1C#N)OC

STK783253
Synonyms: 3- amino- 1- (1- ethyl- 1H- pyrazol- 4- yl)- 1H- benzo[f]chromene- 2- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cnn(c1)CC)c1ccccc1cc2

STK783254
Synonyms: (1S,2S,5R)- 2- [5- (thiophen- 2- yl)- 2- thioxo- 1,3,4- oxadiazol- 3(2H)- yl]- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nc(oc1=S)c1cccs1

STK783255
Synonyms: 2- [4- oxo- 4- (1H- pyrazol- 1- yl)butyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C(n1cccn1)CCCN1C(=O)c2c(C1=O)cccc2

STK687205
Synonyms: (3E)- 4- {[2- amino- 4- (methoxymethyl)- 6- methylthieno[2,3- b]pyridin- 3- yl]amino}pent- 3- en- 2- one
Smiles: COCc1cc(C)nc2c1c(N/C(=C/C(=O)C)/C)c(s2)N

STK687207
Synonyms: 8- (methoxymethyl)- 6- methyl- 3- phenyl- 1H- pyrazolo[3',4':4,5]thieno[2,3- b]pyridine
Smiles: COCc1cc(C)nc2c1c1[nH]nc(c1s2)c1ccccc1

STK783257
Synonyms: 1- (3,5- diamino- 1H- 1,2,4- triazol- 1- yl)ethanone
Smiles: CC(=O)n1nc(nc1N)N

STK687209
Synonyms: 2- amino- 5- chloro- N- (3- fluorophenyl)benzamide
Smiles: Fc1cccc(c1)NC(=O)c1cc(Cl)ccc1N

STK687210
Synonyms: {[2- chloro- 4- (trifluoromethyl)phenyl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1ccc(cc1Cl)C(F)(F)F

STK687211
Synonyms: 3- nitropyridin- 4- ol1- oxide
Smiles: [O-][n+]1ccc(c(c1)[N+](=O)[O-])O

STK783258
Synonyms: 5- bromo- 3- methylpyridin- 2- ol
Smiles: Brc1cnc(c(c1)C)O

STK687214
Synonyms: 4- (N,N- dimethylcarbamimidoyl)benzoicacid
Smiles: CN(C(=N)c1ccc(cc1)C(=O)O)C

STK687215
Synonyms: 2- methoxy- 4,6- dinitrophenol
Smiles: COc1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-]

STK687216
Synonyms: 5- (phenylsulfonyl)benzene- 1,3- diamine
Smiles: Nc1cc(N)cc(c1)S(=O)(=O)c1ccccc1

STK687220
Synonyms: 3,5- bis(phenylsulfanyl)aniline
Smiles: Nc1cc(cc(c1)Sc1ccccc1)Sc1ccccc1

STK687222
Synonyms: 2- [(3,5- dinitrophenyl)sulfanyl]propanoicacid
Smiles: OC(=O)C(Sc1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])C

STK783260
Synonyms: N- (4- fluorophenyl)- 2- oxo- 1,2,3,4- tetrahydropyrimido[1,2- a]benzimidazole- 4- carboxamide
Smiles: O=C1Nc2nc3c(n2C(C1)C(=O)Nc1ccc(cc1)F)cccc3

STK783261
Synonyms: 2- oxo- 2- (phenylamino)ethyl2,3- di(furan- 2- yl)quinoxaline- 6- carboxylate
Smiles: O=C(Nc1ccccc1)COC(=O)c1ccc2c(c1)nc(c(n2)c1ccco1)c1ccco1

STK687226
Synonyms: N- {2- [4- (5- chloro- 6- oxo- 1- phenyl- 1,6- dihydropyridazin- 4- yl)piperazin- 1- yl]- 2- oxoethyl}- N- (4- methoxyphenyl)ethanesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)CC)CC(=O)N1CCN(CC1)c1cnn(c(=O)c1Cl)c1ccccc1

STK783264
Synonyms: 3- chloro- N- [2- (3,4- dimethoxyphenyl)- 3- phenylpropyl]- 1- benzothiophene- 2- carboxamide
Smiles: COc1cc(ccc1OC)C(Cc1ccccc1)CNC(=O)c1sc2c(c1Cl)cccc2

STK783265
Synonyms: 2- amino- 6- ethyl- 5- methyl- 4- (1- methyl- 1H- pyrrol- 2- yl)pyridine- 3- carbonitrile
Smiles: CCc1nc(N)c(c(c1C)c1cccn1C)C#N

STK687227
Synonyms: 4- methyl- 2- {4- [(4- methylpiperazin- 1- yl)carbonyl]phenyl}phthalazin- 1(2H)- one
Smiles: CN1CCN(CC1)C(=O)c1ccc(cc1)n1nc(C)c2c(c1=O)cccc2

STK687233
Synonyms: 2- (5- methoxy- 1H- indol- 3- yl)- 5,7- dipropyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1c[nH]c2c1cc(OC)cc2)CCC

STK687234
Synonyms: (2E)- 2- {[4- (azepan- 1- ylmethyl)thiophen- 2- yl]methylidene}hydrazinecarboxamide
Smiles: NC(=O)N/N=C/c1scc(c1)CN1CCCCCC1

STK687236
Synonyms: 8- amino- N- (3- chloro- 4- fluorophenyl)- 3,4- dihydro- 2H- 1,4- ethanothieno[2,3- b][1,5]naphthyridine- 7- carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)C2CCN1CC2)Nc1ccc(c(c1)Cl)F

STK783269
Synonyms: 1- benzyl- 1,10b- dimethyl- 1,5,6,10b- tetrahydro[1,3]oxazolo[4,3- a]isoquinolin- 3- one
Smiles: O=C1OC(C2(N1CCc1c2cccc1)C)(C)Cc1ccccc1

STK687240
Synonyms: 8- amino- N- [4- (dimethylamino)phenyl]- 3,4- dihydro- 2H- 1,4- ethanothieno[2,3- b][1,5]naphthyridine- 7- carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)C2CCN1CC2)Nc1ccc(cc1)N(C)C

STK783279
Synonyms: N- [2- (1H- benzimidazol- 2- yl)ethyl]- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])NCCc1nc2c([nH]1)cccc2

STK783280
Synonyms: N- (propan- 2- yl)- 3- [4- (1H- pyrrol- 1- yl)phenyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CC(NC(=O)c1onc(n1)c1ccc(cc1)n1cccc1)C

STK687242
Synonyms: 8- methyl- 3- (propan- 2- yl)- 1,2,3,4,8,9- hexahydro- 5H- pyrimido[5,4- e][1,3]thiazolo[3,2- a]pyrimidin- 5- one
Smiles: CC1Cn2c(S1)nc(=O)c1c2NCN(C1)C(C)C

STK687243
Synonyms: {[6- amino- 1- (4- methoxyphenyl)- 4- oxo- 1,4- dihydropyrimidin- 2- yl]sulfanyl}acetonitrile
Smiles: N#CCSc1nc(=O)cc(n1c1ccc(cc1)OC)N

STK783283
Synonyms: N- (5- {[2- (4- amino- 2- oxido- 1,2,5- oxadiazol- 3- yl)- 2- oxoethyl]sulfanyl}- 1,3,4- thiadiazol- 2- yl)acetamide
Smiles: [O-][n+]1onc(c1C(=O)CSc1nnc(s1)NC(=O)C)N

STK783284
Synonyms: 2- methoxy- 5- nitro- 6- oxo- 1,6- dihydropyridine- 3- carbonitrile
Smiles: N#Cc1cc([N+](=O)[O-])c(=O)[nH]c1OC

STK783285
Synonyms: 3- benzyl- 7- (piperidin- 1- yl)- 3H- [1,2,3]triazolo[4,5- d]pyrimidine
Smiles: C1CCN(CC1)c1ncnc2c1nnn2Cc1ccccc1

STK687244
Synonyms: 7- (4- chlorophenyl)- 3- methyl- 5H- [1,2,4]triazolo[3,4- b][1,3]thiazin- 5- one
Smiles: Clc1ccc(cc1)c1cc(=O)n2c(s1)nnc2C

STK783289
Synonyms: 3,5- dibenzyl- 3H- [1,2,3]triazolo[4,5- d]pyrimidin- 7- ol
Smiles: Oc1nc(Cc2ccccc2)nc2c1nnn2Cc1ccccc1

STK783290
Synonyms: ethyl1- ({(3E)- 3- [2- (2- fluorophenyl)hydrazinylidene]- 2- oxo- 2,3- dihydro- 1H- indol- 1- yl}methyl)piperidine- 3- carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CN1c2ccccc2/C(=N\Nc2ccccc2F)/C1=O

STK687249
Synonyms: N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 1- methyl- 3- propyl- 1H- pyrazole- 5- carboxamide
Smiles: CCCc1cc(n(n1)C)C(=O)Nc1c(=O)n(n(c1C)C)c1ccccc1

STK687250
Synonyms: N- {2- [(4- chlorophenyl)carbamoyl]phenyl}- 1- methyl- 3- propyl- 1H- pyrazole- 5- carboxamide
Smiles: CCCc1cc(n(n1)C)C(=O)Nc1ccccc1C(=O)Nc1ccc(cc1)Cl

STK783294
Synonyms: dimethyl5- {[(1- methyl- 3- propyl- 1H- pyrazol- 5- yl)carbonyl]amino}benzene- 1,3- dicarboxylate
Smiles: CCCc1cc(n(n1)C)C(=O)Nc1cc(cc(c1)C(=O)OC)C(=O)OC

STK783295
Synonyms: 1- methyl- N- (naphthalen- 1- yl)- 3- propyl- 1H- pyrazole- 5- carboxamide
Smiles: CCCc1nn(c(c1)C(=O)Nc1cccc2c1cccc2)C

STK783297
Synonyms: 3- cyclopropyl- 1- methyl- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1H- pyrazole- 5- carboxamide
Smiles: O=C(c1cc(nn1C)C1CC1)NC12CC3CC(C2)CC(C1)C3

STK783301
Synonyms: 3- cyclopropyl- 1- methyl- N- {2- [(2- phenoxyethyl)carbamoyl]phenyl}- 1H- pyrazole- 5- carboxamide
Smiles: O=C(c1ccccc1NC(=O)c1cc(nn1C)C1CC1)NCCOc1ccccc1

STK687252
Synonyms: 3- cyclopropyl- 1- methyl- N- (2- phenylethyl)- 1H- pyrazole- 5- carboxamide
Smiles: O=C(c1cc(nn1C)C1CC1)NCCc1ccccc1

STK783303
Synonyms: 3- cyclopropyl- N- (3,5- dimethyltricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1- methyl- 1H- pyrazole- 5- carboxamide
Smiles: O=C(c1cc(nn1C)C1CC1)NC12CC3CC(C2)(CC(C1)(C3)C)C

STK783304
Synonyms: 3- cyclopropyl- 1- methyl- N- (tricyclo[3.3.1.1~3,7~]dec- 2- yl)- 1H- pyrazole- 5- carboxamide
Smiles: O=C(c1cc(nn1C)C1CC1)NC1C2CC3CC1CC(C2)C3

STK783305
Synonyms: [4- (2- fluorophenyl)piperazin- 1- yl][1- methyl- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1H- pyrazol- 5- yl]methanone
Smiles: O=C(c1cc(nn1C)C12CC3CC(C2)CC(C1)C3)N1CCN(CC1)c1ccccc1F

STK783306
Synonyms: N- cyclopropyl- 1- methyl- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1H- pyrazole- 5- carboxamide
Smiles: O=C(c1cc(nn1C)C12CC3CC(C2)CC(C1)C3)NC1CC1

STK687253
Synonyms: N- cyclohexyl- 1- methyl- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1H- pyrazole- 5- carboxamide
Smiles: O=C(c1cc(nn1C)C12CC3CC(C2)CC(C1)C3)NC1CCCCC1

STK687254
Synonyms: 2- [5- (1,3- benzodioxol- 5- yloxy)- 3- nitro- 1H- 1,2,4- triazol- 1- yl]- 1- (morpholin- 4- yl)ethanone
Smiles: O=C(N1CCOCC1)Cn1nc(nc1Oc1ccc2c(c1)OCO2)[N+](=O)[O-]

STK783308
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- (4- ethylphenyl)benzamide
Smiles: CCc1ccc(cc1)NC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1

STK783312
Synonyms: N- (3- methoxyphenyl)hexopyranosylamine
Smiles: OCC1OC(Nc2cccc(c2)OC)C(C(C1O)O)O

STK783313
Synonyms: 6- methyl- 4- phenyl- 3,4- dihydropyrido[3',2':5,6]pyrimido[1,2- a]benzimidazole- 2,5(1H,6H)- dione
Smiles: O=C1CC(c2ccccc2)c2c(N1)n1c3ccccc3nc1n(c2=O)C

STK783314
Synonyms: 4- amino- 5- (phenylcarbonyl)- 1,2- oxazole- 3- carbonitrile
Smiles: N#Cc1noc(c1N)C(=O)c1ccccc1

STK687255
Synonyms: dimethyl2- [(4,6- dimethylpyrimidin- 2- yl)sulfanyl]- 5- nitrobenzene- 1,4- dicarboxylate
Smiles: COC(=O)c1cc([N+](=O)[O-])c(cc1Sc1nc(C)cc(n1)C)C(=O)OC

STK687256
Synonyms: methyl4- bromoselenopheno[2,3- b]selenophene- 2- carboxylate
Smiles: COC(=O)c1[se]c2c(c1)c(c[se]2)Br

STK783315
Synonyms: methyl2- amino- 5- cyano- 6- ethyl- 4- (pyridin- 3- yl)- 4H- pyran- 3- carboxylate
Smiles: COC(=O)C1=C(N)OC(=C(C1c1cccnc1)C#N)CC

STK783319
Synonyms: N- (4- chloro- 2,5- dimethoxyphenyl)- 4- methyl- 1,3- thiazole- 5- carboxamide
Smiles: COc1cc(Cl)c(cc1NC(=O)c1scnc1C)OC

STK687260
Synonyms: [4- (1,3- benzoxazol- 2- yl)piperidin- 1- yl](4- methyl- 1,3- thiazol- 5- yl)methanone
Smiles: Cc1ncsc1C(=O)N1CCC(CC1)c1nc2c(o1)cccc2

STK783320
Synonyms: N- [4- (acetylamino)phenyl]- 2,3- dihydrofuro[3,4- b][1,4]dioxine- 5- carboxamide
Smiles: CC(=O)Nc1ccc(cc1)NC(=O)c1occ2c1OCCO2

STK783321
Synonyms: [4- (1,3- benzoxazol- 2- yl)piperazin- 1- yl](2,3- dihydrofuro[3,4- b][1,4]dioxin- 5- yl)methanone
Smiles: O=C(c1occ2c1OCCO2)N1CCN(CC1)c1nc2c(o1)cccc2

STK783323
Synonyms: N- (4- chloro- 2,5- dimethoxyphenyl)- 2,3- dihydrofuro[3,4- b][1,4]dioxine- 5- carboxamide
Smiles: COc1cc(Cl)c(cc1NC(=O)c1occ2c1OCCO2)OC

STK687263
Synonyms: 3- acetyl- 2- [(1,3- benzodioxol- 5- ylmethyl)amino]- 6- methyl- 4H- pyran- 4- one
Smiles: Cc1cc(=O)c(c(o1)NCc1ccc2c(c1)OCO2)C(=O)C

STK783325
Synonyms: (2E)- 2- {[4- (1H- benzimidazol- 1- ylmethyl)- 5- methylthiophen- 2- yl]methylidene}hydrazinecarboxamide
Smiles: NC(=O)N/N=C/c1cc(c(s1)C)Cn1cnc2c1cccc2

STK783332
Synonyms: N- (2,4- difluorophenyl)- 1,5- dimethyl- 1H- pyrazole- 4- carboxamide
Smiles: Fc1ccc(c(c1)F)NC(=O)c1cnn(c1C)C

STK783333
Synonyms: N- [2- (4- methoxyphenyl)ethyl]- 1,5- dimethyl- 1H- pyrazole- 4- carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)c1cnn(c1C)C

STK783335
Synonyms: 4- cyclopropyl- N- (3,4- dimethoxybenzyl)- 1,3- dimethyl- 1H- pyrazolo[3,4- b]pyridine- 6- carboxamide
Smiles: COc1ccc(cc1OC)CNC(=O)c1cc(C2CC2)c2c(n1)n(C)nc2C

STK783340
Synonyms: 5- bromo- N- [2- (pyridin- 4- yl)ethyl]furan- 2- carboxamide
Smiles: Brc1ccc(o1)C(=O)NCCc1ccncc1

STK783341
Synonyms: diethyl[4- ({[3- (2- chlorophenyl)- 5- methyl- 1,2- oxazol- 4- yl]carbonyl}amino)benzyl]phosphonate
Smiles: CCOP(=O)(Cc1ccc(cc1)NC(=O)c1c(C)onc1c1ccccc1Cl)OCC

STK783342
Synonyms: methylN- ({[5- (4- hydroxybenzyl)- 4- methyl- 1H- imidazol- 2- yl]sulfanyl}acetyl)leucinate
Smiles: COC(=O)C(NC(=O)CSc1nc(c([nH]1)Cc1ccc(cc1)O)C)CC(C)C

STK783348
Synonyms: methylN- ({[6- amino- 4- oxo- 1- (2- phenylethyl)- 1,4- dihydropyrimidin- 2- yl]sulfanyl}acetyl)leucinate
Smiles: COC(=O)C(NC(=O)CSc1nc(=O)cc(n1CCc1ccccc1)N)CC(C)C

STK687266
Synonyms: 2- [4- (2,5- dimethyl- 1H- pyrrol- 1- yl)- 1,2,5- oxadiazol- 3- yl]- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1N(C(=O)c2c1cccc2)c1nonc1n1c(C)ccc1C

STK687267
Synonyms: 3- [5- (4- chlorophenyl)- 4- phenyl- 1H- imidazol- 2- yl]pyridine
Smiles: Clc1ccc(cc1)c1[nH]c(nc1c1ccccc1)c1cccnc1

STK783350
Synonyms: 3- [4,5- bis(4- methoxyphenyl)- 1H- imidazol- 2- yl]pyridine
Smiles: COc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)OC)c1cccnc1

STK783357
Synonyms: naphthalen- 2- yl(5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetate
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])Oc1ccc2c(c1)cccc2

STK783360
Synonyms: 3- [(4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- N- (3- methoxybenzyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: COc1cccc(c1)CNC(=O)c1onc(n1)Cn1nc(c(c1C)Br)C

STK783361
Synonyms: methyl4- {[({3- [(4- nitro- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazol- 5- yl}carbonyl)amino]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)CNC(=O)c1onc(n1)Cn1ncc(c1)[N+](=O)[O-]

STK783365
Synonyms: 3- [(4- nitro- 1H- pyrazol- 1- yl)methyl]- N- [4- (1H- pyrrol- 1- yl)benzyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCc1ccc(cc1)n1cccc1

STK783367
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- [3- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)propyl]- 1,2,4- oxadiazole
Smiles: [O-][N+](=O)c1c(C)nn(c1C)CCCc1onc(n1)c1ccc2c(c1)OCO2

STK783368
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- [3- (3- nitro- 1H- pyrazol- 1- yl)propyl]- 1,2,4- oxadiazole
Smiles: [O-][N+](=O)c1ccn(n1)CCCc1onc(n1)c1ccc2c(c1)OCO2

STK783370
Synonyms: N- (3- methoxybenzyl)- 3- [(phenylsulfonyl)methyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: COc1cccc(c1)CNC(=O)c1onc(n1)CS(=O)(=O)c1ccccc1

STK783371
Synonyms: methyl4- {[({3- [(phenylsulfonyl)methyl]- 1,2,4- oxadiazol- 5- yl}carbonyl)amino]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)CNC(=O)c1onc(n1)CS(=O)(=O)c1ccccc1

STK783375
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (3- cyano- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)acetamide
Smiles: N#Cc1c(NC(=O)Cn2nc(c(c2C)Cl)C)sc2c1CCC2

STK783378
Synonyms: 2- (4- fluorophenoxy)- N- [1- (propan- 2- yl)- 1H- pyrazol- 4- yl]acetamide
Smiles: O=C(Nc1cnn(c1)C(C)C)COc1ccc(cc1)F

STK687273
Synonyms: 3- (1,3- benzodioxol- 5- yl)- N- [3- (dimethylamino)propyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CN(CCCNC(=O)c1onc(n1)c1ccc2c(c1)OCO2)C

STK687274
Synonyms: 3- (1,3- benzodioxol- 5- yl)- N- [2- (diethylamino)ethyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CCN(CCNC(=O)c1onc(n1)c1ccc2c(c1)OCO2)CC

STK783381
Synonyms: N- (3- methoxybenzyl)- 3- [(4- nitro- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: COc1cccc(c1)CNC(=O)c1onc(n1)Cn1ncc(c1)[N+](=O)[O-]

STK687275
Synonyms: 3- (1,3- benzodioxol- 5- yl)- N- {2- [(3S,5S,7S)- tricyclo[3.3.1.1~3,7~]dec- 1- yloxy]ethyl}- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)OCO2)NCCO[C@]12C[C@H]3C[C@@H](C2)C[C@@H](C1)C3

STK783382
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- [(4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazole
Smiles: Cc1nn(c(c1Br)C)Cc1onc(n1)c1ccc2c(c1)OCO2

STK783386
Synonyms: 3- [3- (1,3- benzodioxol- 5- yl)- 1,2,4- oxadiazol- 5- yl]pyridine
Smiles: c1ccc(cn1)c1onc(n1)c1ccc2c(c1)OCO2

STK783387
Synonyms: 4- [3- (1,3- benzodioxol- 5- yl)- 1,2,4- oxadiazol- 5- yl]pyridine
Smiles: n1ccc(cc1)c1onc(n1)c1ccc2c(c1)OCO2

STK783390
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- [(4- iodo- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazole
Smiles: Ic1cnn(c1)Cc1onc(n1)c1ccc2c(c1)OCO2

STK687276
Synonyms: 3- [(4- iodo- 1H- pyrazol- 1- yl)methyl]- N- [2- (pyridin- 2- yl)ethyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Ic1cnn(c1)Cc1noc(n1)C(=O)NCCc1ccccn1

STK783396
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (furan- 2- ylmethyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCc1ccco1

STK687278
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (pyridin- 3- ylmethyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCc1cccnc1

STK783397
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCc1ccc2c(c1)OCO2

STK783398
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (2- phenylethyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCCc1ccccc1

STK687279
Synonyms: ethyl(4- {[(4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)acetyl]amino}- 3,5- dimethyl- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1nc(c(c1C)NC(=O)Cn1nc(c(c1C)Cl)C)C

STK687280
Synonyms: N- (4- fluorobenzyl)- 3- {[2- (trifluoromethyl)- 1H- benzimidazol- 1- yl]methyl}- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1onc(n1)Cn1c2ccccc2nc1C(F)(F)F

STK783400
Synonyms: N- (furan- 2- ylmethyl)- 3- {[2- (trifluoromethyl)- 1H- benzimidazol- 1- yl]methyl}- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1c2ccccc2nc1C(F)(F)F)NCc1ccco1

STK783401
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 3- {[2- (trifluoromethyl)- 1H- benzimidazol- 1- yl]methyl}- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1c2ccccc2nc1C(F)(F)F)NCc1ccc2c(c1)OCO2

STK783403
Synonyms: N- (pyridin- 4- ylmethyl)- 3- {[2- (trifluoromethyl)- 1H- benzimidazol- 1- yl]methyl}- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1c2ccccc2nc1C(F)(F)F)NCc1ccncc1

STK687283
Synonyms: methyl5- [(2,2,6,6- tetramethylpiperidin- 4- yl)carbamoyl]- 1H- imidazole- 4- carboxylate
Smiles: COC(=O)c1nc[nH]c1C(=O)NC1CC(C)(C)NC(C1)(C)C

STK687285
Synonyms: N- (5- chloro- 2- hydroxyphenyl)- 2,4- dinitrobenzamide
Smiles: Clc1ccc(c(c1)NC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])O

STK783408
Synonyms: 8- chloro- 3- phenoxydibenzo[b,f][1,4]oxazepin- 11(10H)- one
Smiles: Clc1ccc2c(c1)NC(=O)c1c(O2)cc(cc1)Oc1ccccc1

STK783409
Synonyms: 8- chloro- 3- (3- methylphenoxy)dibenzo[b,f][1,4]oxazepin- 11(10H)- one
Smiles: Clc1ccc2c(c1)NC(=O)c1c(O2)cc(cc1)Oc1cccc(c1)C

STK687286
Synonyms: 3- (4- chlorophenyl)- 3- {[(2,4- dimethoxyphenyl)carbonyl]amino}propanoicacid
Smiles: COc1cc(OC)ccc1C(=O)NC(c1ccc(cc1)Cl)CC(=O)O

STK687287
Synonyms: 3- [(benzylsulfonyl)amino]- 3- [4- (cyclopentyloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OC1CCCC1)NS(=O)(=O)Cc1ccccc1

STK783411
Synonyms: 1- [2- (4- chlorophenyl)- 2- methyl- 5- phenyl- 1,3,4- oxadiazol- 3(2H)- yl]ethanone
Smiles: Clc1ccc(cc1)C1(C)OC(=NN1C(=O)C)c1ccccc1

STK687289
Synonyms: 3- [4- (cyclopentyloxy)phenyl]- 3- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)propanoicacid
Smiles: OC(=O)CC(N1C(=O)c2c(C1=O)cccc2)c1ccc(cc1)OC1CCCC1

STK783414
Synonyms: 1- [4- (1,3- dioxooctahydro- 2H- isoindol- 2- yl)- 1,2,5- oxadiazol- 3- yl]- 3- phenylurea
Smiles: O=C(Nc1ccccc1)Nc1nonc1N1C(=O)C2C(C1=O)CCCC2

STK687291
Synonyms: 2- {[4- methyl- 5- (2- methylpropyl)- 1H- imidazol- 2- yl]sulfanyl}- N- (4- methylpyridin- 2- yl)acetamide
Smiles: CC(Cc1[nH]c(nc1C)SCC(=O)Nc1nccc(c1)C)C

STK783416
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- [1- (4- fluorobenzyl)- 5- methyl- 1H- pyrazol- 3- yl]acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)Nc1nn(c(c1)C)Cc1ccc(cc1)F

STK687292
Synonyms: 2- {[5- (4- hydroxybenzyl)- 4- methyl- 1H- imidazol- 2- yl]sulfanyl}- N- (1- phenylethyl)acetamide
Smiles: O=C(NC(c1ccccc1)C)CSc1nc(c([nH]1)Cc1ccc(cc1)O)C

STK783418
Synonyms: 3- (2- chlorophenyl)- N- {[3- (4- methoxyphenyl)- 1,2,4- oxadiazol- 5- yl]methyl}- N,5- dimethyl- 1,2- oxazole- 4- carboxamide
Smiles: COc1ccc(cc1)c1noc(n1)CN(C(=O)c1c(C)onc1c1ccccc1Cl)C

STK783419
Synonyms: N- (quinolin- 5- yl)- 2,3- dihydro- 1,4- benzodioxine- 2- carboxamide
Smiles: O=C(C1COc2c(O1)cccc2)Nc1cccc2c1cccn2

STK783421
Synonyms: 3- (3- chlorophenoxy)dibenzo[b,f][1,4]oxazepin- 11(10H)- one
Smiles: Clc1cccc(c1)Oc1ccc2c(c1)Oc1ccccc1NC2=O

STK783430
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 1,5- dimethyl- 1H- pyrazole- 4- carboxamide
Smiles: O=C(c1cnn(c1C)C)Nc1ccc2c(c1)OCCO2

STK687293
Synonyms: 1'- (6- chloropyridazin- 3- yl)- 1,4'- bipiperidine- 4'- carboxamide
Smiles: NC(=O)C1(CCN(CC1)c1ccc(nn1)Cl)N1CCCCC1

STK687294
Synonyms: ethyl3- amino- 1- (phenylcarbonyl)- 5- [(phenylcarbonyl)oxy]- 1H- pyrazole- 4- carboxylate
Smiles: CCOC(=O)c1c(N)nn(c1OC(=O)c1ccccc1)C(=O)c1ccccc1

STK783435
Synonyms: N- [2- (2- chlorophenoxy)ethyl]- 1- methyl- 3- propyl- 1H- pyrazole- 5- carboxamide
Smiles: CCCc1nn(c(c1)C(=O)NCCOc1ccccc1Cl)C

STK783436
Synonyms: 2- oxo- 2,3- dihydro- 1H- benzimidazole- 5,6- dicarbonitrile
Smiles: N#Cc1cc2[nH]c(=O)[nH]c2cc1C#N

STK783437
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 5- (pyridin- 4- yl)- 1,3,4- thiadiazol- 2- amine
Smiles: COc1ccc(cc1Cl)Nc1nnc(s1)c1ccncc1

STK687297
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 5- (pyridin- 3- yl)- 1,3,4- thiadiazol- 2- amine
Smiles: COc1ccc(cc1Cl)Nc1nnc(s1)c1cccnc1

STK783441
Synonyms: 4- (4- {[(5- amino- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}- 5- methylthiophen- 2- yl)- 2- methyl- 5- oxo- N- phenyl- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: Nc1nnc(s1)SCc1cc(sc1C)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)Nc1ccccc1

STK783442
Synonyms: methyl4- [4- (1H- benzimidazol- 1- ylmethyl)- 5- methylthiophen- 2- yl]- 2- methyl- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: COC(=O)C1=C(C)NC2=C(C1c1sc(c(c1)Cn1cnc3c1cccc3)C)C(=O)CCC2

STK783445
Synonyms: 2- amino- 1- (5- methyl- 1,2- oxazol- 3- yl)- 5- oxo- 4- [4- (1H- 1,2,4- triazol- 1- ylmethyl)thiophen- 2- yl]- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(c2noc(c2)C)C2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CCC2

STK783447
Synonyms: N- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 3- (1H- tetrazol- 1- yl)propanamide
Smiles: O=C(Nc1sc(c(n1)C)C)CCn1cnnn1

STK783450
Synonyms: ethyl6- amino- 3- butyl- 5- cyano- 1'H,7H- spiro[1,2- oxazolo[3,4- b]pyridine- 4,4'- piperidine]- 1'- carboxylate
Smiles: CCCCc1onc2c1C1(CCN(CC1)C(=O)OCC)C(=C(N2)N)C#N

STK783451
Synonyms: N- (3- ethoxy- 4- methoxybenzyl)- 2- (trifluoromethyl)- 1H- benzimidazol- 7- amine
Smiles: CCOc1cc(ccc1OC)CNc1cccc2c1[nH]c(n2)C(F)(F)F

STK783452
Synonyms: N- (3- ethoxy- 4- methoxybenzyl)- 2- methyl- 1H- benzimidazol- 7- amine
Smiles: CCOc1cc(CNc2cccc3c2[nH]c(n3)C)ccc1OC

STK783456
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- (1,3- thiazol- 2- yl)benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)Nc1nccs1

STK783458
Synonyms: ethyl5- [({[2,4- dichloro- 5- (cyclopropylsulfamoyl)phenyl]carbonyl}amino)methyl]furan- 2- carboxylate
Smiles: CCOC(=O)c1ccc(o1)CNC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1

STK687302
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- [2- (2- methyl- 1H- indol- 3- yl)ethyl]benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)NCCc1c(C)[nH]c2c1cccc2

STK687303
Synonyms: 2- amino- 4- [4- (azepan- 1- ylmethyl)thiophen- 2- yl]- 5- oxo- 5,6,7,8- tetrahydro- 4H- chromene- 3- carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1scc(c1)CN1CCCCCC1)C(=O)CCC2

STK687304
Synonyms: (2- hydroxypyridin- 3- yl)(oxo)aceticacid
Smiles: Oc1ncccc1C(=O)C(=O)O

STK687305
Synonyms: 1- ethyl- 2,3- dimethylpiperidin- 4- ol
Smiles: CCN1CCC(C(C1C)C)O

STK687306
Synonyms: 1- [2- (3,4- dimethoxyphenyl)ethyl]decahydroquinolin- 4- ol
Smiles: COc1cc(CCN2CCC(C3C2CCCC3)O)ccc1OC

STK687307
Synonyms: 1- tert- butyl- 4- methylpiperidin- 3- ol
Smiles: CC1CCN(CC1O)C(C)(C)C

STK783466
Synonyms: methyl5- cyano- 4- (2,3- dimethoxyphenyl)- 2- methyl- 6- (1H- pyrrol- 1- yl)- 4H- pyran- 3- carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C1c1cccc(c1OC)OC)C#N)n1cccc1

STK783467
Synonyms: ethyl5- cyano- 2- methyl- 6- (1H- pyrrol- 1- yl)- 4- (3,4,5- trimethoxyphenyl)- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1cc(OC)c(c(c1)OC)OC)C#N)n1cccc1

STK783468
Synonyms: ethyl4- (1,3- benzodioxol- 5- yl)- 5- cyano- 2- methyl- 6- (1H- pyrrol- 1- yl)- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1ccc2c(c1)OCO2)C#N)n1cccc1

STK783485
Synonyms: ethyl5- cyano- 4- (3,4- dimethoxyphenyl)- 2- methyl- 6- (1H- pyrrol- 1- yl)- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1ccc(c(c1)OC)OC)C#N)n1cccc1

STK783486
Synonyms: ethyl5- cyano- 4- (2,5- dimethoxyphenyl)- 2- methyl- 6- (1H- pyrrol- 1- yl)- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1cc(OC)ccc1OC)C#N)n1cccc1

STK783489
Synonyms: methyl5- cyano- 4- (4- hydroxy- 3- methoxyphenyl)- 2- methyl- 6- (1H- pyrrol- 1- yl)- 4H- pyran- 3- carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C1c1ccc(c(c1)OC)O)C#N)n1cccc1

STK783493
Synonyms: 4- (4- fluorophenyl)- 3,4- dihydro- 2H- benzo[g]chromene- 2,5,10- trione
Smiles: O=C1CC(c2ccc(cc2)F)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783494
Synonyms: 4- (3- fluorophenyl)- 3,4- dihydro- 2H- benzo[g]chromene- 2,5,10- trione
Smiles: O=C1CC(c2cccc(c2)F)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783495
Synonyms: 4- (3- methoxyphenyl)- 3,4- dihydro- 2H- benzo[g]chromene- 2,5,10- trione
Smiles: COc1cccc(c1)C1CC(=O)OC2=C1C(=O)c1c(C2=O)cccc1

STK783496
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 3,4- dihydro- 2H- benzo[g]chromene- 2,5,10- trione
Smiles: O=C1CC(c2ccc3c(c2)OCO3)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783497
Synonyms: 4- (thiophen- 3- yl)- 3,4- dihydro- 2H- benzo[g]chromene- 2,5,10- trione
Smiles: O=C1CC(c2ccsc2)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783498
Synonyms: 4- [4- (trifluoromethyl)phenyl]- 3,4- dihydro- 2H- benzo[g]chromene- 2,5,10- trione
Smiles: O=C1CC(c2ccc(cc2)C(F)(F)F)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783500
Synonyms: 4- (4- hydroxy- 3- methoxyphenyl)- 3,4- dihydro- 2H- benzo[g]chromene- 2,5,10- trione
Smiles: COc1cc(ccc1O)C1CC(=O)OC2=C1C(=O)c1c(C2=O)cccc1

STK783510
Synonyms: 5- oxo- 4- (pyridin- 3- yl)- 2- (1H- pyrrol- 1- yl)- 5,6,7,8- tetrahydro- 4H- chromene- 3- carbonitrile
Smiles: N#CC1=C(OC2=C(C1c1cccnc1)C(=O)CCC2)n1cccc1

STK687315
Synonyms: 3- methylphenyl{[4- (4- fluorophenyl)- 6- (trifluoromethyl)pyrimidin- 2- yl]carbamoyl}sulfamate
Smiles: Fc1ccc(cc1)c1nc(NC(=O)NS(=O)(=O)Oc2cccc(c2)C)nc(c1)C(F)(F)F

STK687316
Synonyms: 3,3- dimethyl- 1- (3,4,5- trimethoxyphenyl)- 2- azaspiro[4.5]deca- 1,6,9- trien- 8- one
Smiles: COc1cc(cc(c1OC)OC)C1=NC(CC21C=CC(=O)C=C2)(C)C

STK783512
Synonyms: 2- (2- chlorophenyl)- N- (4- methoxyphenyl)- 3- oxo- 2,3- dihydro- 1H- isoindole- 4- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1cccc2c1C(=O)N(C2)c1ccccc1Cl

STK783513
Synonyms: N- (furan- 2- ylmethyl)- 3- oxo- 2- (tetrahydrofuran- 2- ylmethyl)- 2,3- dihydro- 1H- isoindole- 4- carboxamide
Smiles: O=C(c1cccc2c1C(=O)N(C2)CC1CCCO1)NCc1ccco1

STK687318
Synonyms: N- [3- (trifluoromethyl)phenyl]- 2,3- dihydrofuro[3,4- b][1,4]dioxine- 5- carboxamide
Smiles: O=C(c1occ2c1OCCO2)Nc1cccc(c1)C(F)(F)F

STK783517
Synonyms: methyl4- (thiophen- 2- yl)- 2- (trifluoromethyl)- 2H- pyrido[1,2- a][1,3,5]triazine- 2- carboxylate
Smiles: COC(=O)C1(N=c2ccccn2C(=N1)c1cccs1)C(F)(F)F

STK783520
Synonyms: 4- (4- hydroxybenzyl)- 5- methyl- 1,3- dihydro- 2H- imidazole- 2- thione
Smiles: Cc1[nH]c(=S)[nH]c1Cc1ccc(cc1)O

STK687319
Synonyms: 1- benzyloctahydro- 4H- cyclopenta[b]pyridin- 4- one
Smiles: O=C1CCN(C2C1CCC2)Cc1ccccc1

STK687320
Synonyms: 1- phenyl- 1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)methanamine
Smiles: NC(C12CC3CC(C2)CC(C1)C3)c1ccccc1

STK783521
Synonyms: N- {[2- (phenylsulfonyl)- 1,2,3,4- tetrahydroisoquinolin- 1- yl]methyl}benzenesulfonamide
Smiles: O=S(=O)(c1ccccc1)NCC1c2ccccc2CCN1S(=O)(=O)c1ccccc1

STK783524
Synonyms: 2- [1- (4- chlorobenzyl)- 1H- indol- 3- yl]- 2- oxo- N- (pyridin- 4- yl)acetamide
Smiles: Clc1ccc(cc1)Cn1cc(c2c1cccc2)C(=O)C(=O)Nc1ccncc1

STK687323
Synonyms: 5- tert- butyl- 6a- hydroxy- 3a- methylhexahydro- 4H- furo[2,3- c]pyrrol- 4- one
Smiles: O=C1N(CC2(C1(C)CCO2)O)C(C)(C)C

STK783527
Synonyms: 4,5- dimethoxy- 2- (1H- pyrrol- 1- yl)benzonitrile
Smiles: COc1cc(c(cc1OC)C#N)n1cccc1

STK783528
Synonyms: 5,6,7,8- tetrahydronaphthalen- 2- amine
Smiles: Nc1ccc2c(c1)CCCC2

STK783529
Synonyms: 5- ethyl- 4- hydroxy- 3- [2- (5- methoxy- 1H- indol- 3- yl)ethyl]- 4,5- dimethyl- 1,3- oxazolidin- 2- one
Smiles: CCC1(C)OC(=O)N(C1(C)O)CCc1c[nH]c2c1cc(OC)cc2

STK783530
Synonyms: 5- [(pyridin- 3- ylmethyl)amino]- 1H- pyrazole- 4- carbonitrile
Smiles: N#Cc1cn[nH]c1NCc1cccnc1

STK783533
Synonyms: 5- methyl- 4- (morpholin- 4- ylmethyl)thiophene- 2- carbaldehyde
Smiles: O=Cc1cc(c(s1)C)CN1CCOCC1

STK783534
Synonyms: 3- hydroxy- 3- (pyridin- 3- yl)butan- 2- one
Smiles: CC(=O)C(c1cccnc1)(O)C

STK783540
Synonyms: 5,7- dimethyl- 3- nitropyrazolo[1,5- a]pyrimidin- 2(1H)- one
Smiles: Cc1cc(C)n2c(n1)c([N+](=O)[O-])c(=O)[nH]2

STK687331
Synonyms: 6,6'- (4- nitro- 1H- pyrazole- 3,5- diyl)bispyrazolo[1,5- a]pyrimidine- 2- carboxylicacid
Smiles: OC(=O)c1cc2n(n1)cc(cn2)c1n[nH]c(c1[N+](=O)[O-])c1cnc2n(c1)nc(c2)C(=O)O

STK783541
Synonyms: 3- bromo- 6- (4- nitro- 1H- pyrazol- 3- yl)pyrazolo[1,5- a]pyrimidin- 2(1H)- one
Smiles: [O-][N+](=O)c1c[nH]nc1c1cnc2n(c1)[nH]c(=O)c2Br

STK687332
Synonyms: 7- (4- chlorophenyl)- 3- (pyridin- 4- yl)- 5H- [1,2,4]triazolo[3,4- b][1,3]thiazin- 5- one
Smiles: Clc1ccc(cc1)c1cc(=O)n2c(s1)nnc2c1ccncc1

STK687334
Synonyms: 2'- (1,3- benzodioxol- 5- yl)- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: O=C1N(c2ccc3c(c2)OCO3)C(=O)C2C1C1(C(=O)Nc3c1cccc3)N1C2CCC1

STK783546
Synonyms: 2'- (4- fluorophenyl)- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cccc2

STK687335
Synonyms: 2'- (3,4- dimethoxyphenyl)- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: COc1cc(ccc1OC)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cccc2

STK783547
Synonyms: 2'- (3,4- dimethylphenyl)- 5- fluoro- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: Fc1ccc2c(c1)C1(C(=O)N2)N2CCCC2C2C1C(=O)N(C2=O)c1ccc(c(c1)C)C

STK783548
Synonyms: 5- fluoro- 2'- (4- methoxyphenyl)- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: COc1ccc(cc1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(F)cc2

STK783549
Synonyms: 5- fluoro- 2'- (4- fluorophenyl)- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(F)cc2

STK687337
Synonyms: 2,4- dichloro- N- (tetrahydrofuran- 2- ylmethyl)- 5- [(tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl)sulfamoyl]benzamide
Smiles: Clc1cc(Cl)c(cc1S(=O)(=O)NCC12CC3CC(C2)CC(C1)C3)C(=O)NCC1CCCO1

STK783551
Synonyms: N- (3'- acetyl- 5,7- dimethyl- 2- oxo- 1,2- dihydro- 3'H- spiro[indole- 3,2'- [1,3,4]thiadiazol]- 5'- yl)acetamide
Smiles: CC(=O)NC1=NN(C2(S1)C(=O)Nc1c2cc(C)cc1C)C(=O)C

STK687339
Synonyms: 2- [3- (pyridin- 4- yl)- 1H- pyrazol- 5- yl][1,2,4]triazolo[1,5- c]quinazoline
Smiles: n1ccc(cc1)c1n[nH]c(c1)c1nn2c(n1)c1ccccc1nc2

STK687342
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- (3- methylpent- 1- yn- 3- yl)benzamide
Smiles: CCC(NC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)(C#C)C

STK783557
Synonyms: methyl3- methyl- 4- {[3- (1H- tetrazol- 1- yl)propanoyl]amino}benzoate
Smiles: COC(=O)c1ccc(c(c1)C)NC(=O)CCn1cnnn1

STK783558
Synonyms: 1,3- diacetyl- 9- methyl- 2- thioxo- 1,2,3,4- tetrahydro- 5H- 6,1,3- benzoxadiazocin- 5- one
Smiles: O=C1CN(C(=O)C)C(=S)N(c2c(O1)ccc(c2)C)C(=O)C

STK783559
Synonyms: 4- (cyclohex- 1- en- 1- yl)- 1,2,3,4- tetrahydro- 1,10- phenanthroline
Smiles: C1CCC(=CC1)C1CCNc2c1ccc1c2nccc1

STK687348
Synonyms: N- (3,5- diphenyl- 4H- 1,2,4- triazol- 4- yl)naphthalene- 2- sulfonamide
Smiles: O=S(=O)(c1ccc2c(c1)cccc2)Nn1c(nnc1c1ccccc1)c1ccccc1

STK687351
Synonyms: 4- [(4- fluorophenyl)carbonyl]- 3- hydroxy- 1- {2- [(2- hydroxyethyl)amino]ethyl}- 5- (4- methoxyphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: OCCNCCN1C(c2ccc(cc2)OC)C(=C(C1=O)O)C(=O)c1ccc(cc1)F

STK783566
Synonyms: 1,3,7- trimethyl- 8- (2- methylphenyl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Cc1ccccc1n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)C

STK687371
Synonyms: methyl(5,5- dimethyl- 4,6- dioxo- 2- phenyltetrahydro- 2H- pyran- 3- yl)acetate
Smiles: COC(=O)CC1C(OC(=O)C(C1=O)(C)C)c1ccccc1

STK783567
Synonyms: 2- (pyridin- 3- yl)- 5H- [1,3,4]thiadiazolo[2,3- b]quinazolin- 5- one
Smiles: O=c1c2ccccc2nc2n1nc(s2)c1cccnc1

STK687382
Synonyms: 2- [(4,6- dimethylpyrimidin- 2- yl)sulfanyl]- N- (5,6,7,8,9,10- hexahydrocycloocta[4,5]thieno[2,3- d]pyrimidin- 4- yl)acetamide
Smiles: O=C(Nc1ncnc2c1c1CCCCCCc1s2)CSc1nc(C)cc(n1)C

STK783571
Synonyms: N- [4- chloro- 2- (trifluoromethyl)phenyl]- 2- (6- nitro- 3- oxo- 1,2- benzothiazol- 2(3H)- yl)acetamide
Smiles: O=C(Cn1sc2c(c1=O)ccc(c2)[N+](=O)[O-])Nc1ccc(cc1C(F)(F)F)Cl

STK783575
Synonyms: 4- hydroxy- 3- [4- (1H- imidazol- 1- yl)butyl]- 4,5,5- trimethyl- 1,3- oxazolidin- 2- one
Smiles: O=C1OC(C(N1CCCCn1cncc1)(C)O)(C)C

STK783576
Synonyms: N- (4- fluorophenyl)- 3- (4- hydroxy- 4,5,5- trimethyl- 2- oxo- 1,3- oxazolidin- 3- yl)propanamide
Smiles: O=C(Nc1ccc(cc1)F)CCN1C(=O)OC(C1(C)O)(C)C

STK783577
Synonyms: 3- (5- ethyl- 4- hydroxy- 4,5- dimethyl- 2- oxo- 1,3- oxazolidin- 3- yl)- N- (4- fluorophenyl)propanamide
Smiles: CCC1(C)OC(=O)N(C1(C)O)CCC(=O)Nc1ccc(cc1)F

STK783578
Synonyms: N- (4- fluorophenyl)- 3- (4- hydroxy- 4- methyl- 2- oxo- 1- oxa- 3- azaspiro[4.5]dec- 3- yl)propanamide
Smiles: O=C(Nc1ccc(cc1)F)CCN1C(=O)OC2(C1(C)O)CCCCC2

STK783579
Synonyms: 4- hydroxy- 4- methyl- 3- [(2- methylphenyl)amino]- 1- oxa- 3- azaspiro[4.5]decan- 2- one
Smiles: O=C1OC2(C(N1Nc1ccccc1C)(C)O)CCCCC2

STK783580
Synonyms: 2- [(1H- benzotriazol- 4- ylamino)methyl]- 4,6- diiodophenol
Smiles: Ic1cc(CNc2cccc3c2nn[nH]3)c(c(c1)I)O

STK783582
Synonyms: 7- (4- chlorophenyl)- 3- (2- fluorophenyl)- 5H- [1,2,4]triazolo[3,4- b][1,3]thiazin- 5- one
Smiles: Clc1ccc(cc1)c1cc(=O)n2c(s1)nnc2c1ccccc1F

STK783584
Synonyms: 4- amino- N- methyl- 5- (phenylcarbonyl)- 1,2- oxazole- 3- carboxamide
Smiles: CNC(=O)c1noc(c1N)C(=O)c1ccccc1

STK783586
Synonyms: 3- (2- fluorophenyl)- 7- (4- methylphenyl)- 5H- [1,2,4]triazolo[3,4- b][1,3]thiazin- 5- one
Smiles: Cc1ccc(cc1)c1cc(=O)n2c(s1)nnc2c1ccccc1F

STK783590
Synonyms: 4- amino- N- (4- fluorophenyl)- 5- (phenylcarbonyl)- 1,2- oxazole- 3- carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1noc(c1N)C(=O)c1ccccc1

STK783593
Synonyms: methyl5- (furan- 2- yl)- 1- methyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrido[2,3- d]pyrimidine- 7- carboxylate
Smiles: COC(=O)c1cc(c2ccco2)c2c(n1)n(C)c(=O)[nH]c2=O

STK687392
Synonyms: 4- acetyl- 3- hydroxy- 1- [2- (1H- imidazol- 4- yl)ethyl]- 5- (thiophen- 2- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1cccs1)CCc1c[nH]cn1

STK783596
Synonyms: 5- (4- fluorophenyl)- 4- [(4- fluorophenyl)carbonyl]- 3- hydroxy- 1- [2- (1H- imidazol- 4- yl)ethyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Fc1ccc(cc1)C1N(CCc2c[nH]cn2)C(=O)C(=C1C(=O)c1ccc(cc1)F)O

STK783597
Synonyms: 5- (3- fluorophenyl)- 4- [(4- fluorophenyl)carbonyl]- 3- hydroxy- 1- [2- (1H- imidazol- 4- yl)ethyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Fc1cccc(c1)C1N(CCc2c[nH]cn2)C(=O)C(=C1C(=O)c1ccc(cc1)F)O

STK687394
Synonyms: 3- hydroxy- 1- {3- [(2- hydroxyethyl)amino]propyl}- 5- phenyl- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: OCCNCCCN1C(c2ccccc2)C(=C(C1=O)O)C(=O)c1ccccc1

STK687395
Synonyms: 1- (4- chlorobenzyl)- 1H- indole- 3- carboxylicacid
Smiles: Clc1ccc(cc1)Cn1cc(c2c1cccc2)C(=O)O

STK687396
Synonyms: 5- (3,4- diethoxybenzyl)- 1H- tetrazole
Smiles: CCOc1cc(ccc1OCC)Cc1nnn[nH]1

STK783599
Synonyms: N- [4- (dimethylamino)- 6- ({5- [4- (trifluoromethyl)phenyl]- 2H- tetrazol- 2- yl}methyl)- 1,3,5- triazin- 2- yl]acetamide
Smiles: CC(=O)Nc1nc(Cn2nnc(n2)c2ccc(cc2)C(F)(F)F)nc(n1)N(C)C

STK687397
Synonyms: [3- (ethoxycarbonyl)- 5- methoxy- 2- methyl- 1H- indol- 1- yl]aceticacid
Smiles: CCOC(=O)c1c(C)n(c2c1cc(OC)cc2)CC(=O)O

STK687398
Synonyms: 4- (cyclohexylamino)tricyclo[3.3.1.1~3,7~]decan- 1- ol
Smiles: OC12CC3CC(C2)C(C(C1)C3)NC1CCCCC1

STK783603
Synonyms: 1,4,5,7- tetramethyl- 6- phenyl- 6H- pyrrolo[3,4- d]pyridazine
Smiles: Cc1nnc(c2c1c(C)n(c2C)c1ccccc1)C

STK783604
Synonyms: 2- chloro- 5- (1,4,5,7- tetramethyl- 6H- pyrrolo[3,4- d]pyridazin- 6- yl)aniline
Smiles: Clc1ccc(cc1N)n1c(C)c2c(c1C)c(C)nnc2C

STK687401
Synonyms: 6,8- dichloro- 3- [(4- methylpiperazin- 1- yl)carbonyl]- 2H- chromen- 2- one
Smiles: CN1CCN(CC1)C(=O)c1cc2cc(Cl)cc(c2oc1=O)Cl

STK783608
Synonyms: ethyl3- {[(6- chloro- 2- oxo- 2H- chromen- 3- yl)carbonyl]amino}- 3- (4- methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1cc2cc(Cl)ccc2oc1=O

STK783611
Synonyms: 1- [(5- fluoro- 2- methoxyphenyl)sulfonyl]- 4- methyl- 2- phenyl- 1H- imidazole
Smiles: COc1ccc(cc1S(=O)(=O)n1cc(nc1c1ccccc1)C)F

STK783612
Synonyms: 4- [3- (2,3- dihydro- 1H- inden- 5- yloxy)- 2- hydroxypropyl]- N,N- dimethylpiperazine- 1- sulfonamide
Smiles: OC(CN1CCN(CC1)S(=O)(=O)N(C)C)COc1ccc2c(c1)CCC2

STK783619
Synonyms: 6- chloro- N- {1- [4- (1H- imidazol- 1- yl)phenyl]ethyl}- 2- oxo- 2H- chromene- 3- carboxamide
Smiles: Clc1ccc2c(c1)cc(c(=O)o2)C(=O)NC(c1ccc(cc1)n1cncc1)C

STK783622
Synonyms: N- {1- [4- (1H- imidazol- 1- yl)phenyl]ethyl}- 2- methyl- 5- nitrobenzenesulfonamide
Smiles: CC(c1ccc(cc1)n1cncc1)NS(=O)(=O)c1cc(ccc1C)[N+](=O)[O-]

STK783626
Synonyms: 1- [4- (morpholin- 4- ylsulfonyl)piperazin- 1- yl]- 3- (1H- 1,2,4- triazol- 1- yl)propan- 1- one
Smiles: O=C(N1CCN(CC1)S(=O)(=O)N1CCOCC1)CCn1ncnc1

STK783630
Synonyms: N- (1H- indazol- 7- yl)- 2,5- dimethoxy- 4- methylbenzenesulfonamide
Smiles: COc1cc(C)c(cc1S(=O)(=O)Nc1cccc2c1[nH]nc2)OC

STK783631
Synonyms: 2,5- diethoxy- N- (1H- indazol- 7- yl)- 4- methylbenzenesulfonamide
Smiles: CCOc1cc(C)c(cc1S(=O)(=O)Nc1cccc2c1[nH]nc2)OCC

STK783632
Synonyms: 3- tert- butyl- N- (1H- indazol- 7- yl)- 4- methoxybenzenesulfonamide
Smiles: COc1ccc(cc1C(C)(C)C)S(=O)(=O)Nc1cccc2c1[nH]nc2

STK687404
Synonyms: 3- benzyl- 5- [(4- fluorobenzyl)sulfanyl]- 3,6- dihydro- 7H- [1,2,3]triazolo[4,5- d]pyrimidin- 7- one
Smiles: Fc1ccc(cc1)CSc1[nH]c(=O)c2c(n1)n(nn2)Cc1ccccc1

STK687408
Synonyms: methyl2- [(benzylamino)methyl]- 5- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)furan- 3- carboxylate
Smiles: COC(=O)c1cc(oc1CNCc1ccccc1)C12CC3CC(C2)CC(C1)C3

STK687410
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 2- (trifluoromethyl)- 1H- benzimidazol- 7- amine
Smiles: FC(c1nc2c([nH]1)c(ccc2)NCc1ccc2c(c1)OCO2)(F)F

STK783634
Synonyms: N- (4- fluorobenzyl)- 2- (trifluoromethyl)- 1H- benzimidazol- 7- amine
Smiles: Fc1ccc(cc1)CNc1cccc2c1[nH]c(n2)C(F)(F)F

STK687412
Synonyms: 5- hydroxy- 1- phenyl- 5- (trifluoromethyl)- 5,7- dihydro- 1H- pyrrolo[2,3- d]pyrimidine- 2,4,6(3H)- trione
Smiles: O=C1Nc2c(C1(O)C(F)(F)F)c(=O)[nH]c(=O)n2c1ccccc1

STK783637
Synonyms: 5,5- dimethyl- 2,6- dioxo- 4- phenylpiperidine- 3- carbonitrile
Smiles: N#CC1C(=O)NC(=O)C(C1c1ccccc1)(C)C

STK687413
Synonyms: 1- cyano- 2- methyl- 3- phenyl- 2- (phenylcarbonyl)cyclopropanecarboxamide
Smiles: N#CC1(C(=O)N)C(C1(C)C(=O)c1ccccc1)c1ccccc1

STK783638
Synonyms: 1- cyano- 2- methyl- N- (3- methylphenyl)- 3- phenyl- 2- (phenylcarbonyl)cyclopropanecarboxamide
Smiles: N#CC1(C(=O)Nc2cccc(c2)C)C(C1(C)C(=O)c1ccccc1)c1ccccc1

STK783639
Synonyms: 7- (4- methylphenyl)- 5H- [1,2,4]triazolo[3,4- b][1,3]thiazin- 5- one
Smiles: Cc1ccc(cc1)c1cc(=O)n2c(s1)nnc2

STK783644
Synonyms: methyl4- [(carbamoylamino)methyl]- 5- ethylfuran- 2- carboxylate
Smiles: COC(=O)c1cc(c(o1)CC)CNC(=O)N

STK687416
Synonyms: 1- (3- O- butanoyl- 2- deoxypentofuranosyl)- 5- methylpyrimidine- 2,4(1H,3H)- dione
Smiles: CCCC(=O)OC1CC(OC1CO)n1cc(C)c(=O)[nH]c1=O

STK687417
Synonyms: 4- [(2- fluoro- 4,5- dimethoxyphenyl)sulfonyl]- 3,4- dihydro- 2H- 1,4- benzoxazine
Smiles: COc1cc(c(cc1OC)F)S(=O)(=O)N1CCOc2c1cccc2

STK687419
Synonyms: 2- [(1E)- 1- hydrazinylideneethyl]- 4- (methoxymethyl)- 6- methylthieno[2,3- b]pyridin- 3- amine
Smiles: COCc1cc(C)nc2c1c(N)c(s2)/C(=N/N)/C

STK687420
Synonyms: N- {4- [1- benzyl- 5- (methoxymethyl)- 7- methyl- 4- oxo- 1,2,3,4- tetrahydropyrido[2,3- d]pyrimidin- 2- yl]phenyl}acetamide
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2Cc1ccccc1)c1ccc(cc1)NC(=O)C

STK783646
Synonyms: 2- [4- (dimethylamino)phenyl]- 1- (4- fluorophenyl)- 5- (methoxymethyl)- 7- methyl- 2,3- dihydropyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2c1ccc(cc1)F)c1ccc(cc1)N(C)C

STK687421
Synonyms: 4- (methoxymethyl)- 6- methyl- 2- [(2,2,6,6- tetramethylpiperidin- 4- yl)amino]pyridine- 3- carboxamide
Smiles: COCc1cc(C)nc(c1C(=O)N)NC1CC(C)(C)NC(C1)(C)C

STK687423
Synonyms: 4- [5- (4,4- diethyl- 1,4- dihydro- 2H- 3,1- benzoxazin- 2- yl)furan- 2- yl]benzoicacid
Smiles: CCC1(CC)OC(Nc2c1cccc2)c1ccc(o1)c1ccc(cc1)C(=O)O

STK687424
Synonyms: ethyl({(1Z)- 1- [(5- cyano- 2,4- dimethyl- 1H- pyrrol- 3- yl)methylidene]- 6- methyl- 3- oxo- 1,3- dihydrofuro[3,4- c]pyridin- 4- yl}sulfanyl)acetate
Smiles: CCOC(=O)CSc1nc(C)cc2c1C(=O)O/C/2=C\c1c(C)[nH]c(c1C)C#N

STK687425
Synonyms: 2- {(E)- [(2- amino- 4,6- dimethylthieno[2,3- b]pyridin- 3- yl)imino]methyl}phenol
Smiles: Cc1cc(C)c2c(n1)sc(c2/N=C/c1ccccc1O)N

STK687430
Synonyms: 12- benzyl- 4- (methoxymethyl)- 2- methyl- 11b,12- dihydropyrido[2',3':4,5]pyrimido[2,1- a]isoindole- 5,7- dione
Smiles: COCc1cc(C)nc2c1C(=O)N1C(=O)c3c(C1N2Cc1ccccc1)cccc3

STK687431
Synonyms: 2- {[3- (hydrazinylcarbonyl)- 4- (hydroxymethyl)- 6- methylpyridin- 2- yl]sulfanyl}- N- (quinolin- 8- yl)acetamide
Smiles: NNC(=O)c1c(SCC(=O)Nc2cccc3c2nccc3)nc(cc1CO)C

STK783652
Synonyms: 4- (4,4- diphenyl- 1,4- dihydro- 2H- 3,1- benzoxazin- 2- yl)- 3,5- dimethyl- 1H- pyrrole- 2- carbonitrile
Smiles: N#Cc1[nH]c(c(c1C)C1Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1)C

STK687433
Synonyms: 4- (methoxymethyl)- 6- methyl- 2- propoxypyridine- 3- carbonitrile
Smiles: CCCOc1nc(C)cc(c1C#N)COC

STK783653
Synonyms: 5- chloro- 3- cyano- N- cyclopropyl- 4,6- dimethylpyridine- 2- sulfonamide
Smiles: N#Cc1c(C)c(Cl)c(nc1S(=O)(=O)NC1CC1)C

STK687434
Synonyms: 3- amino- N- (6- cyano- 1,3- benzodioxol- 5- yl)- 4,5,6- trimethylthieno[2,3- b]pyridine- 2- carboxamide
Smiles: N#Cc1cc2OCOc2cc1NC(=O)c1sc2c(c1N)c(C)c(c(n2)C)C

STK783659
Synonyms: ethyl4- amino- 3- cyano- 10- (4- methoxyphenyl)- 8- methylpyrido[2',3':3,4]pyrazolo[5,1- c][1,2,4]triazine- 9- carboxylate
Smiles: CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)OC)c1nnc(c(n1n2)N)C#N

STK783662
Synonyms: 8- [2- (3,4- dimethoxyphenyl)ethyl]- 1,3,6- trimethyl- 7- (4- methylphenyl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1cc(ccc1OC)CCn1c2nc3c(n2c(c1c1ccc(cc1)C)C)c(=O)n(c(=O)n3C)C

STK783666
Synonyms: 6- (3,5- dimethylphenyl)- 1- methyl- 4- phenyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: Cc1cc(C)cc(c1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccccc1

STK783667
Synonyms: 6- (3,5- dichlorophenyl)- 1- methyl- 4- phenyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: Clc1cc(Cl)cc(c1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccccc1

STK783668
Synonyms: 6- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- (4- methoxyphenyl)- 1- methyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: COc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)C1CCS(=O)(=O)C1)C

STK687441
Synonyms: 4- (4- hydroxy- 3- methoxyphenyl)- 1- methyl- 6- phenyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: COc1cc(ccc1O)C1NC(=O)N(C2=C1C(=O)N(C2)c1ccccc1)C

STK783669
Synonyms: 6- (3- chlorophenyl)- 4- (4- hydroxy- 3- methoxyphenyl)- 1- methyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: COc1cc(ccc1O)C1NC(=O)N(C2=C1C(=O)N(C2)c1cccc(c1)Cl)C

STK783676
Synonyms: 8- (2- methoxyethyl)- 1,3,6- trimethyl- 7- phenyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COCCn1c2nc3c(n2c(c1c1ccccc1)C)c(=O)n(c(=O)n3C)C

STK783683
Synonyms: 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 7,9- dimethyl- 3- phenyl- 1,4- dihydro[1,2,4]triazino[3,4- f]purine- 6,8(7H,9H)- dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n1CC(=NN(c1n2)C1CCS(=O)(=O)C1)c1ccccc1

STK783687
Synonyms: 6- (4- chlorophenyl)- 1- methyl- 4- phenyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: Clc1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccccc1

STK783689
Synonyms: 6- (1,1- dioxidotetrahydrothiophen- 3- yl)- 1- methyl- 4- phenyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: O=C1NC(c2ccccc2)C2=C(N1C)CN(C2=O)C1CCS(=O)(=O)C1

STK783690
Synonyms: 6- (4- chlorophenyl)- 4- (4- methoxyphenyl)- 1- methyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: COc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)c1ccc(cc1)Cl)C

STK783693
Synonyms: 4- (4- hydroxyphenyl)- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: O=C1CC(c2ccc(cc2)O)c2c(O1)c1ccccc1[nH]c2=O

STK687444
Synonyms: 1'- (3- chloro- 4- fluorophenyl)- 2,5'- dioxo- 1- (prop- 2- yn- 1- yl)- 2'- (1H- pyrrol- 1- yl)- 1,2,5',6',7',8'- hexahydro- 1'H- spiro[indole- 3,4'- quinoline]- 3'- carbonitrile
Smiles: C#CCN1c2ccccc2C2(C1=O)C(=C(n1cccc1)N(C1=C2C(=O)CCC1)c1ccc(c(c1)Cl)F)C#N

STK783706
Synonyms: 1- cyclopentyl- 3,4- dimethyl- 1,7- dihydro- 6H- pyrazolo[3,4- b]pyridin- 6- one
Smiles: Cc1nn(c2c1c(C)cc(=O)[nH]2)C1CCCC1

STK783707
Synonyms: 1- (2,2- dimethyltetrahydro- 2H- pyran- 4- yl)- 3- methyl- 4- phenyl- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: O=C1CSC(c2c(N1)n(nc2C)C1CCOC(C1)(C)C)c1ccccc1

STK687446
Synonyms: 1- benzyl- 3,4,6- trimethyl- 1H- pyrazolo[3,4- b]pyridine
Smiles: Cc1cc(C)c2c(n1)n(Cc1ccccc1)nc2C

STK783711
Synonyms: N- [4- (2,3- dihydro- 1,4- benzodioxin- 2- yl)- 1,3- thiazol- 2- yl]acetamide
Smiles: CC(=O)Nc1scc(n1)C1COc2c(O1)cccc2

STK783713
Synonyms: 7- methyl- 2- oxo- 2,3- dihydro[1,3]thiazolo[4,5- b]pyridin- 5- ylacetate
Smiles: CC(=O)Oc1cc(C)c2c(n1)[nH]c(=O)s2

STK783717
Synonyms: 1- (4- fluorophenyl)- 3- [3- (imidazo[1,2- a]pyrimidin- 2- yl)phenyl]urea
Smiles: O=C(Nc1ccc(cc1)F)Nc1cccc(c1)c1cn2c(n1)nccc2

STK783719
Synonyms: N- (4- chlorophenyl)- 6- (pyrrolidin- 1- yl)pyridazin- 3- amine
Smiles: Clc1ccc(cc1)Nc1ccc(nn1)N1CCCC1

STK783721
Synonyms: N- [4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- 1,2,5- oxadiazol- 3- yl]- 4- methylbenzamide
Smiles: O=C(c1ccc(cc1)C)Nc1nonc1N1C(=O)c2c(C1=O)cccc2

STK783725
Synonyms: 6- (3,4,5- trimethoxyphenyl)- 6,9- dihydropyrido[3,2- e][1,2,4]triazolo[1,5- a]pyrimidine- 5,8(4H,7H)- dione
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)Nc2c1c(=O)[nH]c1n2ncn1

STK783729
Synonyms: ethyl5- cyano- 2- methyl- 6- (1H- pyrrol- 1- yl)- 4- (2,3,4- trimethoxyphenyl)- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1ccc(c(c1OC)OC)OC)C#N)n1cccc1

STK783730
Synonyms: methyl5- cyano- 4- (4- hydroxyphenyl)- 2- methyl- 6- (1H- pyrrol- 1- yl)- 4H- pyran- 3- carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C1c1ccc(cc1)O)C#N)n1cccc1

STK783733
Synonyms: 4- (2,3- dimethoxyphenyl)- 3,4- dihydro- 2H- benzo[g]chromene- 2,5,10- trione
Smiles: COc1cccc(c1OC)C1CC(=O)OC2=C1C(=O)c1c(C2=O)cccc1

STK783735
Synonyms: 4- [4- (propan- 2- yl)phenyl]- 3,4- dihydro- 2H- benzo[g]chromene- 2,5,10- trione
Smiles: O=C1CC(c2ccc(cc2)C(C)C)C2=C(O1)C(=O)c1c(C2=O)cccc1

STK783737
Synonyms: 4- [4- (benzyloxy)phenyl]- 6- methyl- 3,4- dihydropyrido[3',2':5,6]pyrimido[1,2- a]benzimidazole- 2,5(1H,6H)- dione
Smiles: O=C1CC(c2ccc(cc2)OCc2ccccc2)c2c(N1)n1c3ccccc3nc1n(c2=O)C

STK783738
Synonyms: 4- {4- [(2- fluorobenzyl)oxy]phenyl}- 6- methyl- 3,4- dihydropyrido[3',2':5,6]pyrimido[1,2- a]benzimidazole- 2,5(1H,6H)- dione
Smiles: O=C1CC(c2ccc(cc2)OCc2ccccc2F)c2c(N1)n1c3ccccc3nc1n(c2=O)C

STK783739
Synonyms: 6- methyl- 4- {4- [(3- methylbenzyl)oxy]phenyl}- 3,4- dihydropyrido[3',2':5,6]pyrimido[1,2- a]benzimidazole- 2,5(1H,6H)- dione
Smiles: O=C1CC(c2ccc(cc2)OCc2cccc(c2)C)c2c(N1)n1c3ccccc3nc1n(c2=O)C

STK783740
Synonyms: 4- {4- [(3- chlorobenzyl)oxy]phenyl}- 6- methyl- 3,4- dihydropyrido[3',2':5,6]pyrimido[1,2- a]benzimidazole- 2,5(1H,6H)- dione
Smiles: O=C1CC(c2ccc(cc2)OCc2cccc(c2)Cl)c2c(N1)n1c3ccccc3nc1n(c2=O)C

STK783749
Synonyms: 1- [(6- oxo- 3- phenyl- 1,6- dihydropyridazin- 4- yl)amino]- 4- phenyl- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=c1[nH]nc(c(c1)NN1C(=O)CC(C2=C1CCCC2=O)c1ccccc1)c1ccccc1

STK783751
Synonyms: 4- (4- fluorophenyl)- 1- [(6- oxo- 3- phenyl- 1,6- dihydropyridazin- 4- yl)amino]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)Nc1cc(=O)[nH]nc1c1ccccc1

STK783762
Synonyms: 2- [(2- methyl- 4- nitro- 1H- imidazol- 5- yl)sulfanyl]ethanol
Smiles: [O-][N+](=O)c1nc([nH]c1SCCO)C

STK687456
Synonyms: 8a- phenylhexahydropyrrolo[1,2- a]pyrazine- 1,4- dione
Smiles: O=C1CNC(=O)C2(N1CCC2)c1ccccc1

STK783769
Synonyms: 2- (1H- indol- 3- yl)- 5,7- diphenyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- ol
Smiles: OC1C2(CN3CC1(CN(C2)C3c1c[nH]c2c1cccc2)c1ccccc1)c1ccccc1

STK783775
Synonyms: (cyanomethyl)[4- (morpholin- 4- yl)- 6- (propan- 2- ylamino)- 1,3,5- triazin- 2- yl]cyanamide
Smiles: N#CCN(c1nc(NC(C)C)nc(n1)N1CCOCC1)C#N

STK783777
Synonyms: 2- [4- (1H- pyrrol- 1- yl)- 1,2,5- oxadiazol- 3- yl]hexahydro- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1C2CCCCC2C(=O)N1c1nonc1n1cccc1

STK687458
Synonyms: 3- (2,4- dichlorophenyl)- 3- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)propanoicacid
Smiles: OC(=O)CC(N1C(=O)c2c(C1=O)cccc2)c1ccc(cc1Cl)Cl

STK783780
Synonyms: (5Z)- 3- [2- (1H- benzimidazol- 2- yl)ethyl]- 5- (1,3- benzodioxol- 5- ylmethylidene)- 2- (3- nitrophenyl)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: O=C1/C(=C/c2ccc3c(c2)OCO3)/N=C(N1CCc1nc2c([nH]1)cccc2)c1cccc(c1)[N+](=O)[O-]

STK783784
Synonyms: (5Z)- 3- [2- (1H- benzimidazol- 2- yl)ethyl]- 2- (5- bromofuran- 2- yl)- 5- (4- methoxybenzylidene)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: COc1ccc(cc1)/C=C/1\N=C(N(C1=O)CCc1nc2c([nH]1)cccc2)c1ccc(o1)Br

STK687465
Synonyms: 2- [4- (1,3- dioxooctahydro- 2H- isoindol- 2- yl)- 1,2,5- oxadiazol- 3- yl]- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1C2CCCCC2C(=O)N1c1nonc1N1C(=O)c2c(C1=O)cccc2

STK783788
Synonyms: N- (5- chloropyridin- 2- yl)- 2- {[5- (4- hydroxybenzyl)- 4- methyl- 1H- imidazol- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cn1)Cl)CSc1[nH]c(c(n1)C)Cc1ccc(cc1)O

STK783792
Synonyms: 2- (5- {4- [(2- chloro- 6- fluorobenzyl)oxy]phenyl}- 2H- tetrazol- 2- yl)- N- (3- methylpent- 1- yn- 3- yl)acetamide
Smiles: CCC(NC(=O)Cn1nnc(n1)c1ccc(cc1)OCc1c(F)cccc1Cl)(C#C)C

STK783794
Synonyms: N- (4- methoxyphenyl)- 6- methyl[1,2,4]triazolo[4,3- b]pyridazin- 8- amine
Smiles: COc1ccc(cc1)Nc1cc(C)nn2c1nnc2

STK687468
Synonyms: 6- methyl- 8- (4- methylpiperazin- 1- yl)[1,2,4]triazolo[4,3- b]pyridazine
Smiles: CN1CCN(CC1)c1cc(C)nn2c1nnc2

STK687469
Synonyms: ethyl4- {[(4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)Cn1nc(c(c1C)Cl)C

STK783807
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (1- phenylethyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NC(c1ccccc1)C

STK783808
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- [5- (2- phenylethyl)- 1,3,4- thiadiazol- 2- yl]acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)Nc1nnc(s1)CCc1ccccc1

STK783830
Synonyms: N- (3- chlorophenyl)- 4- (4- methylphenyl)- 1- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Cc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)Cl)c1ccccc1

STK687532
Synonyms: ethyl2- {[({2- [2- (3- acetyl- 6- methyl- 4- oxo- 4H- pyran- 2- yl)hydrazinyl]- 2- oxoethyl}sulfanyl)acetyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSCC(=O)NNc2oc(C)cc(=O)c2C(=O)C)sc2c1CCCC2

STK687533
Synonyms: 6- (methylsulfanyl)- N,N'- di(propan- 2- yl)- 1,3,5- triazine- 2,4- diamine
Smiles: CSc1nc(NC(C)C)nc(n1)NC(C)C

STK783850
Synonyms: 3- benzyl- 1- [2- (4- chlorophenoxy)ethyl]- 5- methylpyrimidine- 2,4(1H,3H)- dione
Smiles: Clc1ccc(cc1)OCCn1cc(C)c(=O)n(c1=O)Cc1ccccc1

STK783860
Synonyms: 1,3- dimethyl- 7- [1- (4- methylphenyl)- 1- oxopropan- 2- yl]- 8- (morpholin- 4- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)C(=O)C(n1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCOCC1)C

STK783869
Synonyms: 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4,7,9- trimethyl- 3- (4- methylphenyl)- 1,4- dihydro[1,2,4]triazino[3,4- f]purine- 6,8(7H,9H)- dione
Smiles: Cc1ccc(cc1)C1=NN(C2CCS(=O)(=O)C2)c2n(C1C)c1c(=O)n(C)c(=O)n(c1n2)C

STK783872
Synonyms: ethyl4- [4- (4- methoxyphenyl)- 1- methyl- 2,5- dioxo- 1,2,3,4,5,7- hexahydro- 6H- pyrrolo[3,4- d]pyrimidin- 6- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccc(cc1)OC

STK687557
Synonyms: 8- (2- fluorobenzyl)- 5- (2- fluorophenyl)- 7- oxo- 7,8- dihydro[1,2,4]triazolo[4,3- a]pyrimidine- 6- carbonitrile
Smiles: N#Cc1c(=O)n(Cc2ccccc2F)c2n(c1c1ccccc1F)cnn2

STK687558
Synonyms: 8- amino- 6- tert- butyl- 3- (4- chlorophenyl)[1,2,4]triazolo[4,3- b][1,2,4]triazin- 7(8H)- one
Smiles: Clc1ccc(cc1)c1nnc2n1nc(c(=O)n2N)C(C)(C)C

STK687560
Synonyms: 2'- (1,3- benzodioxol- 5- yl)- 7- (trifluoromethyl)- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: O=C1N(c2ccc3c(c2)OCO3)C(=O)C2C1C1CCCN1C12C(=O)Nc2c1cccc2C(F)(F)F

STK783884
Synonyms: 1,1'- [6- (thiophen- 2- yl)- 5H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine- 5,7- diyl]diethanone
Smiles: CC(=O)c1sc2nncn2n(c1c1cccs1)C(=O)C

STK783886
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (1- oxidopyridin- 3- yl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccc[n+](c1)[O-])c1nonc1N

STK783891
Synonyms: 2'- amino- 7'- methyl- 2,5'- dioxo- 1'- (pyridin- 3- yl)- 1,2,5',6',7',8'- hexahydro- 1'H- spiro[indole- 3,4'- quinoline]- 3'- carbonitrile
Smiles: N#CC1=C(N)N(c2cccnc2)C2=C(C31C(=O)Nc1c3cccc1)C(=O)CC(C2)C

STK687569
Synonyms: 4- (2- fluorophenyl)- 1- [(6- oxo- 3- phenyl- 1,6- dihydropyridazin- 4- yl)amino]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=c1[nH]nc(c(c1)NN1C(=O)CC(C2=C1CCCC2=O)c1ccccc1F)c1ccccc1

STK687570
Synonyms: ethyl5- oxo- 4- (thiophen- 2- yl)- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: CCOC(=O)C1=CNC2=C(C1c1cccs1)C(=O)CCC2

STK687573
Synonyms: 7- (morpholin- 4- ylsulfonyl)- 5H- [1,3]thiazolo[3,2- a]quinazolin- 5- one
Smiles: O=c1nc2sccn2c2c1cc(cc2)S(=O)(=O)N1CCOCC1

STK783893
Synonyms: N- (3- {methyl[(2- oxo- 1,3- benzoxazol- 3(2H)- yl)acetyl]amino}propyl)- N'- (4- methylphenyl)ethanediamide
Smiles: Cc1ccc(cc1)NC(=O)C(=O)NCCCN(C(=O)Cn1c(=O)oc2c1cccc2)C

STK687574
Synonyms: 9- chloro- 8- (piperidin- 1- ylsulfonyl)- 6H- pyrido[1,2- a]quinazolin- 6- one
Smiles: Clc1cc2c(cc1S(=O)(=O)N1CCCCC1)c(=O)nc1n2cccc1

STK783895
Synonyms: 9- chloro- 8- [(4- methylpiperidin- 1- yl)sulfonyl]- 6H- pyrido[1,2- a]quinazolin- 6- one
Smiles: CC1CCN(CC1)S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)cccc3

STK687576
Synonyms: 8- (piperidin- 1- ylsulfonyl)- 6H- pyrido[1,2- a]quinazolin- 6- one
Smiles: O=c1nc2ccccn2c2c1cc(cc2)S(=O)(=O)N1CCCCC1

STK783896
Synonyms: 8- [(3- methylpiperidin- 1- yl)sulfonyl]- 6H- pyrido[1,2- a]quinazolin- 6- one
Smiles: CC1CCCN(C1)S(=O)(=O)c1ccc2c(c1)c(=O)nc1n2cccc1

STK687577
Synonyms: 8- (morpholin- 4- ylsulfonyl)- 6H- pyrido[1,2- a]quinazolin- 6- one
Smiles: O=c1nc2ccccn2c2c1cc(cc2)S(=O)(=O)N1CCOCC1

STK783898
Synonyms: 2- chloro- 8- (morpholin- 4- ylsulfonyl)- 6H- pyrido[1,2- a]quinazolin- 6- one
Smiles: Clc1ccc2n(c1)c1ccc(cc1c(=O)n2)S(=O)(=O)N1CCOCC1

STK687581
Synonyms: methylN- propan- 2- yl- N- prop- 2- yn- 1- yl- beta- alaninate
Smiles: COC(=O)CCN(C(C)C)CC#C

STK783902
Synonyms: 4- (5- fluoro- 1- methyl- 1H- indol- 3- yl)- 6- methyl- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: O=C1CC(c2c(O1)c1ccccc1n(c2=O)C)c1cn(c2c1cc(F)cc2)C

STK783912
Synonyms: 4- (4- fluorophenyl)- 7,7- dimethyl- 1- [(6- oxo- 3- phenyl- 1,6- dihydropyridazin- 4- yl)amino]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CC(C2)(C)C)Nc1cc(=O)[nH]nc1c1ccccc1

STK783914
Synonyms: 4- (4- hydroxyphenyl)- 1- [(6- oxo- 3- phenyl- 1,6- dihydropyridazin- 4- yl)amino]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Oc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)Nc1cc(=O)[nH]nc1c1ccccc1

STK783916
Synonyms: 4- (1H- tetrazol- 1- yl)- N- [2- (trifluoromethyl)- 1H- benzimidazol- 4- yl]benzamide
Smiles: O=C(c1ccc(cc1)n1cnnn1)Nc1cccc2c1nc([nH]2)C(F)(F)F

STK783918
Synonyms: 4- (3,4- dimethoxyphenyl)- 3,4- dihydro- 2H- benzo[g]chromene- 2,5,10- trione
Smiles: COc1ccc(cc1OC)C1CC(=O)OC2=C1C(=O)c1c(C2=O)cccc1

STK783925
Synonyms: 9- chloro- N,N- diethyl- 6- oxo- 6H- pyrido[1,2- a]quinazoline- 8- sulfonamide
Smiles: CCN(S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)cccc3)CC

STK687586
Synonyms: 9- chloro- 8- [(2- methylpiperidin- 1- yl)sulfonyl]- 6H- pyrido[1,2- a]quinazolin- 6- one
Smiles: CC1CCCCN1S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)cccc3

STK783926
Synonyms: 9- chloro- N- (4- methoxyphenyl)- N- methyl- 6- oxo- 6H- pyrido[1,2- a]quinazoline- 8- sulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)cccc3)C

STK783929
Synonyms: N- (4- methoxyphenyl)- N- methyl- 6- oxo- 6H- pyrido[1,2- a]quinazoline- 8- sulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc2c(c1)c(=O)nc1n2cccc1)C

STK783948
Synonyms: 2- methoxyethyl1- (2- fluorobenzyl)- 5- hydroxy- 2- methyl- 1H- benzo[g]indole- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)n(c2c1cc(O)c1c2cccc1)Cc1ccccc1F

STK783951
Synonyms: 1- (4- tert- butylphenyl)- 3- {[4- (pyridin- 4- ylcarbonyl)phenyl]amino}propan- 1- one
Smiles: O=C(c1ccc(cc1)C(C)(C)C)CCNc1ccc(cc1)C(=O)c1ccncc1

STK783952
Synonyms: 1- (4- tert- butylphenyl)- 3- (4- ethylphenyl)- 3- [(3- fluorophenyl)amino]propan- 1- one
Smiles: CCc1ccc(cc1)C(CC(=O)c1ccc(cc1)C(C)(C)C)Nc1cccc(c1)F

STK783954
Synonyms: 1- (4- tert- butylphenyl)- 3- (4- ethoxyphenyl)- 3- [(4- fluorophenyl)amino]propan- 1- one
Smiles: CCOc1ccc(cc1)C(CC(=O)c1ccc(cc1)C(C)(C)C)Nc1ccc(cc1)F

STK783956
Synonyms: N- [3- (1H- imidazol- 1- yl)propyl]- 3- [4- (1H- pyrrol- 1- yl)phenyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NCCCn1ccnc1

STK687596
Synonyms: N- [2- (dimethylamino)ethyl]- 3- [(4- nitro- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CN(CCNC(=O)c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])C

STK783958
Synonyms: N- (1H- benzimidazol- 2- ylmethyl)- 2- (4- fluorophenyl)acetamide
Smiles: O=C(Cc1ccc(cc1)F)NCc1nc2c([nH]1)cccc2

STK783959
Synonyms: N- (1H- benzimidazol- 2- ylmethyl)- 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCc1nc2c([nH]1)cccc2

STK783961
Synonyms: N- [2- (1H- benzimidazol- 2- yl)ethyl]- 2- (4- fluorophenyl)acetamide
Smiles: O=C(Cc1ccc(cc1)F)NCCc1nc2c([nH]1)cccc2

STK783962
Synonyms: 3- [(phenylsulfonyl)methyl]- N- [2- (tricyclo[3.3.1.1~3,7~]dec- 1- yloxy)ethyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)CS(=O)(=O)c1ccccc1)NCCOC12CC3CC(C2)CC(C1)C3

STK783966
Synonyms: 1H- 1,2,4- triazol- 1- ylmethanol
Smiles: OCn1cncn1

STK783967
Synonyms: 2- methyl- 7- (morpholin- 4- ylsulfonyl)- 9- nitro- 5H- [1,3,4]thiadiazolo[3,2- a]quinazolin- 5- one
Smiles: Cc1nn2c(s1)nc(=O)c1c2c(cc(c1)S(=O)(=O)N1CCOCC1)[N+](=O)[O-]

STK783968
Synonyms: N- (2- fluorophenyl)- 2- imino- 4- oxo- 1,3- thiazinane- 6- carboxamide
Smiles: O=C1NC(=N)SC(C1)C(=O)Nc1ccccc1F

STK783973
Synonyms: N,N'- pyridine- 2,6- diyldiacetamide
Smiles: CC(=O)Nc1cccc(n1)NC(=O)C

STK783978
Synonyms: (8R,8aR)- 6- amino- 8- (2,3- dimethoxyphenyl)- 8,8a- dihydro- 1H- isothiochromene- 5,7,7(3H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCSC2)c1cccc(c1OC)OC)(C#N)C#N

STK783982
Synonyms: 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)- N- hydroxybutanamide
Smiles: ONC(=O)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK783984
Synonyms: 2- methyl- 4- [5- methyl- 4- (morpholin- 4- ylmethyl)thiophen- 2- yl]- 5- oxo- N- phenyl- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: CC1=C(C(=O)Nc2ccccc2)C(C2=C(N1)CCCC2=O)c1sc(c(c1)CN1CCOCC1)C

STK783985
Synonyms: 4- [4- acetyl- 5- methyl- 5- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 4,5- dihydro- 1,3,4- oxadiazol- 2- yl]phenylacetate
Smiles: CC(=O)N1N=C(OC1(C)C12CC3CC(C2)CC(C1)C3)c1ccc(cc1)OC(=O)C

STK783989
Synonyms: (1S,2S,5R)- 2- {3- [(3,4- dimethylphenoxy)methyl]- 4- phenyl- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl}- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nc(n(c1=S)c1ccccc1)COc1ccc(c(c1)C)C

STK783990
Synonyms: 3- (1H- tetrazol- 1- yl)- N- [6- (trifluoromethoxy)- 1,3- benzothiazol- 2- yl]propanamide
Smiles: O=C(Nc1nc2c(s1)cc(cc2)OC(F)(F)F)CCn1cnnn1

STK783991
Synonyms: 3,5- bis(3- aminophenyl)- 4H- 1,2,4- triazol- 4- amine
Smiles: Nc1cccc(c1)c1nnc(n1N)c1cccc(c1)N

STK783994
Synonyms: N- ({4- [3- phenyl- 5- (trifluoromethyl)- 1H- pyrazol- 1- yl]phenyl}carbamoyl)benzamide
Smiles: O=C(NC(=O)c1ccccc1)Nc1ccc(cc1)n1nc(cc1C(F)(F)F)c1ccccc1

STK784008
Synonyms: 2- methoxy- N- [2- (pyridin- 4- yl)ethyl]benzamide
Smiles: COc1ccccc1C(=O)NCCc1ccncc1

STK784012
Synonyms: methyl3- (acetylamino)- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C)cc(cc2)F

STK784013
Synonyms: N- (2- amino- 4- ethoxyphenyl)- 2- hydroxypropanamide
Smiles: CCOc1ccc(c(c1)N)NC(=O)C(O)C

STK687613
Synonyms: ethyl2- oxo- 1,1',2,2',5',6',7',7a'- octahydrospiro[indole- 3,3'- pyrrolizine]- 1'- carboxylate
Smiles: CCOC(=O)C1CC2(N3C1CCC3)C(=O)Nc1c2cccc1

STK687614
Synonyms: octahydro- 4H- cyclopenta[b]pyridin- 4- one
Smiles: O=C1CCNC2C1CCC2

STK687616
Synonyms: 1,2,5- oxadiazole- 3,4- dicarbonitrile
Smiles: N#Cc1nonc1C#N

STK784021
Synonyms: 4- amino- 2- oxo- 1,2- dihydropyrimidine- 5- carbonitrile
Smiles: Nc1nc(=O)[nH]cc1C#N

STK784024
Synonyms: 1- [3- (furan- 2- yl)- 3- hydroxyprop- 1- yn- 1- yl]cyclohexanol
Smiles: OC(c1ccco1)C#CC1(O)CCCCC1

STK784025
Synonyms: 4,6- dichloro- 1H- indole- 2,3- dione
Smiles: Clc1cc2NC(=O)C(=O)c2c(c1)Cl

STK784026
Synonyms: ethyl4- hydroxyquinazoline- 2- carboxylate
Smiles: CCOC(=O)c1nc(O)c2c(n1)cccc2

STK687619
Synonyms: 3- (2,3- dihydroimidazo[2,1- b][1,3]thiazol- 6- yl)propanoicacid
Smiles: OC(=O)CCc1cn2c(n1)SCC2

STK784027
Synonyms: 4,6- dimethoxy- 1H- indole
Smiles: COc1cc(OC)c2c(c1)[nH]cc2

STK687620
Synonyms: 4,6- dimethoxy- 1H- indole- 2- carboxylicacid
Smiles: COc1cc(OC)cc2c1cc([nH]2)C(=O)O

STK784028
Synonyms: 5,6,7- trimethoxy- 1H- indole- 2- carboxylicacid
Smiles: COc1cc2cc([nH]c2c(c1OC)OC)C(=O)O

STK687621
Synonyms: 3- formyl- 5,6- dimethoxy- 1H- indole- 2- carboxylicacid
Smiles: COc1cc2[nH]c(c(c2cc1OC)C=O)C(=O)O

STK687622
Synonyms: 2- amino- 4,6- dichlorobenzoicacid
Smiles: Clc1cc(N)c(c(c1)Cl)C(=O)O

STK784029
Synonyms: 1- acetyl- 4,6- dichloro- 1H- indole- 2,3- dione
Smiles: Clc1cc(Cl)c2c(c1)N(C(=O)C)C(=O)C2=O

STK687623
Synonyms: 5,7- dichloro- 2- methylquinoline- 4- carboxylicacid
Smiles: Clc1cc(Cl)c2c(c1)nc(cc2C(=O)O)C

STK687625
Synonyms: 1H- 1,2,3- triazol- 5- ylmethanol
Smiles: OCc1cnn[nH]1

STK784032
Synonyms: 4- amino- N- phenyl- 5- (phenylcarbonyl)- 1,2- oxazole- 3- carboxamide
Smiles: O=C(c1noc(c1N)C(=O)c1ccccc1)Nc1ccccc1

STK784043
Synonyms: methyl4- ({[4- (4- nitro- 1H- pyrazol- 1- yl)butanoyl]amino}methyl)benzoate
Smiles: COC(=O)c1ccc(cc1)CNC(=O)CCCn1ncc(c1)[N+](=O)[O-]

STK784044
Synonyms: 4- {4- [(4- fluorobenzyl)oxy]phenyl}- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: O=C1CC(c2ccc(cc2)OCc2ccc(cc2)F)c2c(O1)c1ccccc1[nH]c2=O

STK784045
Synonyms: 4- (3- fluorophenyl)- 1- [(6- oxo- 3- phenyl- 1,6- dihydropyridazin- 4- yl)amino]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Fc1cccc(c1)C1CC(=O)N(C2=C1C(=O)CCC2)Nc1cc(=O)[nH]nc1c1ccccc1

STK687631
Synonyms: 3- (1- hydroxycyclohexyl)prop- 2- ynoicacid
Smiles: OC(=O)C#CC1(O)CCCCC1

STK687632
Synonyms: 2- methoxy- 4,6- dinitrobenzoicacid
Smiles: COc1cc(cc(c1C(=O)O)[N+](=O)[O-])[N+](=O)[O-]

STK784046
Synonyms: methyl[1- (4- chlorobenzyl)- 1H- indol- 3- yl](oxo)acetate
Smiles: COC(=O)C(=O)c1cn(c2c1cccc2)Cc1ccc(cc1)Cl

STK687634
Synonyms: 3- (octylsulfinyl)propan- 1- ol
Smiles: CCCCCCCCS(=O)CCCO

STK687635
Synonyms: 4- (octylsulfonyl)butan- 1- ol
Smiles: CCCCCCCCS(=O)(=O)CCCCO

STK687636
Synonyms: 4- (octylsulfinyl)butan- 1- ol
Smiles: CCCCCCCCS(=O)CCCCO

STK687637
Synonyms: 3- (octylsulfonyl)propan- 1- ol
Smiles: CCCCCCCCS(=O)(=O)CCCO

STK784048
Synonyms: 1- (ethylsulfonyl)- 2- {[2- (ethylsulfonyl)ethyl]sulfanyl}ethane
Smiles: CCS(=O)(=O)CCSCCS(=O)(=O)CC

STK687638
Synonyms: (dodecylsulfanyl)aceticacid
Smiles: CCCCCCCCCCCCSCC(=O)O

STK687639
Synonyms: 2- (octylsulfinyl)ethanol
Smiles: CCCCCCCCS(=O)CCO

STK687640
Synonyms: 3- (dodecylsulfinyl)propanoicacid
Smiles: CCCCCCCCCCCCS(=O)CCC(=O)O

STK784049
Synonyms: 2- (hexylsulfonyl)ethanol
Smiles: CCCCCCS(=O)(=O)CCO

STK784052
Synonyms: 1- (2,2- diphenylethenyl)- 2- nitrobenzene
Smiles: [O-][N+](=O)c1ccccc1/C=C(\c1ccccc1)/c1ccccc1

STK687642
Synonyms: 1,1',1''- (2- bromoethene- 1,1,2- triyl)tribenzene
Smiles: Br/C(=C(/c1ccccc1)\c1ccccc1)/c1ccccc1

STK687643
Synonyms: 1- (methylsulfonyl)- 4- nitrobenzene
Smiles: [O-][N+](=O)c1ccc(cc1)S(=O)(=O)C

STK784054
Synonyms: N,N- dimethyl- 4- (methylsulfonyl)aniline
Smiles: CN(c1ccc(cc1)S(=O)(=O)C)C

STK784055
Synonyms: 4- {(E)- 2- [4- (dimethylamino)phenyl]ethenyl}benzonitrile
Smiles: N#Cc1ccc(cc1)/C=C/c1ccc(cc1)N(C)C

STK687648
Synonyms: 3- (tert- butylsulfinyl)propanoicacid
Smiles: OC(=O)CCS(=O)C(C)(C)C

STK784056
Synonyms: 7- benzyl- 2,6- dichloro- 7H- purine
Smiles: Clc1nc(Cl)c2c(n1)ncn2Cc1ccccc1

STK687649
Synonyms: 1- [(1,3- dichloropropan- 2- yl)sulfonyl]butane
Smiles: CCCCS(=O)(=O)C(CCl)CCl

STK784057
Synonyms: 1- ({2- [2- (butylsulfonyl)ethoxy]ethyl}sulfonyl)butane
Smiles: CCCCS(=O)(=O)CCOCCS(=O)(=O)CCCC

STK784058
Synonyms: 1- [(2- {[2- (butylsulfonyl)ethyl]sulfinyl}ethyl)sulfonyl]butane
Smiles: CCCCS(=O)(=O)CCS(=O)CCS(=O)(=O)CCCC

STK687650
Synonyms: 1- [(2- {[2- (octylsulfonyl)ethyl]sulfanyl}ethyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CCSCCS(=O)(=O)CCCCCCCC

STK687651
Synonyms: 1- ethyl- 2,5- dimethylpiperidin- 4- one
Smiles: CCN1CC(C)C(=O)CC1C

STK687654
Synonyms: 10- (thiophen- 2- yl)decanoicacid
Smiles: OC(=O)CCCCCCCCCc1cccs1

STK784061
Synonyms: methyl6- [5- (5- methoxy- 5- oxopentyl)thiophen- 2- yl]hexanoate
Smiles: COC(=O)CCCCCc1ccc(s1)CCCCC(=O)OC

STK687657
Synonyms: 1- [(2- chloroethyl)sulfinyl]decane
Smiles: CCCCCCCCCCS(=O)CCCl

STK784065
Synonyms: 2- (ethylsulfonyl)ethylcarbamimidothioate
Smiles: CCS(=O)(=O)CCSC(=N)N

STK687660
Synonyms: 2,6- dibromo- 3,5- dimethoxypyrazine
Smiles: COc1nc(OC)c(nc1Br)Br

STK784067
Synonyms: 3,5- dinitropyrazine- 2,6- diamine
Smiles: Nc1nc(N)c(nc1[N+](=O)[O-])[N+](=O)[O-]

STK687661
Synonyms: 3,5- dimethoxy- 2,6- dinitropyrazine1- oxide
Smiles: COc1nc(OC)c([n+](c1[N+](=O)[O-])[O-])[N+](=O)[O-]

STK784068
Synonyms: 5- amino- 6- bromo- 2,2- dimethyl- 2,3- dihydro- 7H- [1,3]thiazolo[3,2- a]pyrimidin- 7- one
Smiles: O=c1nc2SC(Cn2c(c1Br)N)(C)C

STK687662
Synonyms: 5- amino- 1- (2- cyanoethyl)- 1H- pyrazole- 4- carbonitrile
Smiles: N#CCCn1ncc(c1N)C#N

STK687663
Synonyms: (butylsulfonyl)aceticacid
Smiles: CCCCS(=O)(=O)CC(=O)O

STK687664
Synonyms: 2- (octylsulfonyl)ethanol
Smiles: CCCCCCCCS(=O)(=O)CCO

STK687666
Synonyms: N- (acridin- 9- yl)acetamide
Smiles: CC(=O)Nc1c2ccccc2nc2c1cccc2

STK687667
Synonyms: 1,1- di(biphenyl- 4- yl)methanamine
Smiles: NC(c1ccc(cc1)c1ccccc1)c1ccc(cc1)c1ccccc1

STK687668
Synonyms: 1- (2,2- dichloroethenyl)- 4- nitrobenzene
Smiles: ClC(=Cc1ccc(cc1)[N+](=O)[O-])Cl

STK687670
Synonyms: 2- (dodecylsulfanyl)ethanol
Smiles: CCCCCCCCCCCCSCCO

STK687671
Synonyms: 1- [(2,3- dichloropropyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CC(CCl)Cl

STK687673
Synonyms: 2- (decylsulfonyl)ethylcarbamimidothioate
Smiles: CCCCCCCCCCS(=O)(=O)CCSC(=N)N

STK687675
Synonyms: 2- (octylsulfonyl)ethyloctane- 1- sulfonate
Smiles: CCCCCCCCS(=O)(=O)CCOS(=O)(=O)CCCCCCCC

STK784072
Synonyms: (1Z,2E)- N,N'- dihydroxy- 1- phenylethane- 1,2- diimine
Smiles: O/N=C(/c1ccccc1)\C=N\O

STK784073
Synonyms: 2,6- diamino- 5- {[(E)- furan- 2- ylmethylidene]amino}pyrimidin- 4- ol
Smiles: Nc1nc(N)c(c(n1)O)/N=C/c1ccco1

STK687676
Synonyms: (2E)- 2- [(5E)- 5- (hydroxyimino)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylidene]hydrazinecarbothioamide
Smiles: NC(=S)N/N=C\1/C(=N/O)/CCc2c1non2

STK784074
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)acetamide
Smiles: CC(=O)Nc1cccc2c1non2

STK784093
Synonyms: 7- methyl- 6- (4- methylphenyl)- 2- phenylimidazo[1,2- b][1,2,4]triazine
Smiles: Cc1ccc(cc1)c1nc2n(c1C)nc(cn2)c1ccccc1

STK784098
Synonyms: 6- (4- hydroxyphenyl)- 1- methyl- 4- (3- nitrophenyl)- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: Oc1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1cccc(c1)[N+](=O)[O-]

STK784100
Synonyms: 6- (4- ethylphenyl)- 1- methyl- 4- (3- nitrophenyl)- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: CCc1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1cccc(c1)[N+](=O)[O-]

STK784101
Synonyms: 6- (3- chlorophenyl)- 1- methyl- 4- (3- nitrophenyl)- 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)c1cccc(c1)[N+](=O)[O-]

STK784105
Synonyms: 6- (3,4- dimethylphenyl)- 1- methyl- 4- (3- nitrophenyl)- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: CN1C(=O)NC(C2=C1CN(C2=O)c1ccc(c(c1)C)C)c1cccc(c1)[N+](=O)[O-]

STK784107
Synonyms: 6- (3- hydroxyphenyl)- 1- methyl- 4- (3- nitrophenyl)- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: Oc1cccc(c1)N1CC2=C(C1=O)C(NC(=O)N2C)c1cccc(c1)[N+](=O)[O-]

STK784109
Synonyms: 4- (4- hydroxy- 3- methoxyphenyl)- 6- (4- methoxyphenyl)- 1- methyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: COc1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccc(c(c1)OC)O

STK687677
Synonyms: 3- (1H- tetrazol- 5- yl)- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- amine
Smiles: Nc1sc2c(c1c1nnn[nH]1)CCCC2

STK687679
Synonyms: 2- {1- [(4- hydroxyphenyl)amino]ethylidene}- 1H- indene- 1,3(2H)- dione
Smiles: C/C(=C/1\C(=O)c2c(C1=O)cccc2)/Nc1ccc(cc1)O

STK784112
Synonyms: 1- methyl- 4- (3- nitrophenyl)- 6- [3- (trifluoromethyl)phenyl]- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: O=C1NC(c2cccc(c2)[N+](=O)[O-])C2=C(N1C)CN(C2=O)c1cccc(c1)C(F)(F)F

STK784114
Synonyms: 3- amino- 4- {[2- (piperidin- 1- ylcarbonyl)phenyl]amino}- 2H- chromen- 2- one
Smiles: O=C(c1ccccc1Nc1c(N)c(=O)oc2c1cccc2)N1CCCCC1

STK687687
Synonyms: 2,6- dimethoxy- 3,5- dinitropyridine
Smiles: COc1nc(OC)c(cc1[N+](=O)[O-])[N+](=O)[O-]

STK687689
Synonyms: 3- [4- (7- chloroquinolin- 4- yl)piperazin- 1- yl]- 1- (3,5- dimethoxyphenyl)pyrrolidine- 2,5- dione
Smiles: COc1cc(OC)cc(c1)N1C(=O)CC(C1=O)N1CCN(CC1)c1ccnc2c1ccc(c2)Cl

STK784116
Synonyms: 2- bromo- N- [2- (pyridin- 4- yl)ethyl]benzamide
Smiles: O=C(c1ccccc1Br)NCCc1ccncc1

STK687691
Synonyms: 2- ethoxy- N- [2- methyl- 4- (5- methyl- 1,2,4- oxadiazol- 3- yl)phenyl]benzamide
Smiles: CCOc1ccccc1C(=O)Nc1ccc(cc1C)c1noc(n1)C

STK784121
Synonyms: (3E)- 3- [2- imino- 4- oxo- 3- (1,3- thiazol- 2- yl)- 1,3- thiazolidin- 5- ylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: N=C1S/C(=C\2/C(=O)Nc3c2cccc3)/C(=O)N1c1nccs1

STK687694
Synonyms: methyl2- {2- [(4- chlorophenyl)amino]- 2- oxoethyl}- 6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinoline- 3- carboxylate
Smiles: COC(=O)C1Cc2cc(OC)c(cc2CN1CC(=O)Nc1ccc(cc1)Cl)OC

STK687695
Synonyms: N- (1,3- benzothiazol- 2- yl)- 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)Nc1nc2c(s1)cccc2

STK687696
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (5- methyl- 1,2- oxazol- 3- yl)acetamide
Smiles: Cc1onc(c1)NC(=O)Cn1nc(c(c1C)Cl)C

STK784122
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- 1- (3,4- dihydroisoquinolin- 2(1H)- yl)ethanone
Smiles: O=C(N1CCc2c(C1)cccc2)Cn1nc(c(c1C)Cl)C

STK784123
Synonyms: 3'- (4- fluorophenyl)- 5,7- dimethyl- 4'H- spiro[indole- 3,2'- [1,3]thiazolidine]- 2,4'(1H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)CSC21C(=O)Nc1c2cc(C)cc1C

STK687697
Synonyms: 5- fluoro- 3- hydroxy- 3- (2- oxopropyl)- 1,3- dihydro- 2H- indol- 2- one
Smiles: CC(=O)CC1(O)C(=O)Nc2c1cc(F)cc2

STK687699
Synonyms: N- [2- (diethylamino)ethyl]- 2- (6H- indolo[2,3- b]quinoxalin- 6- yl)acetamide
Smiles: CCN(CCNC(=O)Cn1c2ccccc2c2c1nc1ccccc1n2)CC

STK784124
Synonyms: 3'- acetyl- 5'- (4- nitrobenzyl)- 3'H- spiro[indole- 3,2'- [1,3,4]oxadiazol]- 2(1H)- one
Smiles: CC(=O)N1N=C(OC21C(=O)Nc1c2cccc1)Cc1ccc(cc1)[N+](=O)[O-]

STK784125
Synonyms: 3'- acetyl- 5'- (4- bromophenyl)- 3'H- spiro[indole- 3,2'- [1,3,4]oxadiazol]- 2(1H)- one
Smiles: Brc1ccc(cc1)C1=NN(C2(O1)C(=O)Nc1c2cccc1)C(=O)C

STK784128
Synonyms: naphthalen- 2- yl(3- nitro- 1H- pyrazol- 1- yl)acetate
Smiles: O=C(Cn1ccc(n1)[N+](=O)[O-])Oc1ccc2c(c1)cccc2

STK784129
Synonyms: N- [4- (dimethylamino)- 6- ({[4- (morpholin- 4- yl)- 1,2,5- thiadiazol- 3- yl]oxy}methyl)- 1,3,5- triazin- 2- yl]acetamide
Smiles: CC(=O)Nc1nc(COc2nsnc2N2CCOCC2)nc(n1)N(C)C

STK784135
Synonyms: 2- (4- bromophenyl)pyrido[2,3- b]pyrazine
Smiles: Brc1ccc(cc1)c1cnc2c(n1)cccn2

STK784136
Synonyms: (1S,2S,5R)- 2- [4- (pyridin- 3- yl)- 5- thioxo- 4,5- dihydro- 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)n1nnn(c1=S)c1cccnc1

STK784140
Synonyms: N- [1- (propan- 2- yl)- 1H- pyrazol- 4- yl]pyrazine- 2- carboxamide
Smiles: O=C(c1cnccn1)Nc1cnn(c1)C(C)C

STK687701
Synonyms: 3- [(pyridin- 2- ylmethyl)sulfanyl]- 7H- [1,2,4]triazolo[4,3- b][1,2,4]triazole
Smiles: c1ccc(nc1)CSc1nnc2n1nc[nH]2

STK687702
Synonyms: 6,13- di(prop- 2- yn- 1- yl)- 13,13a- dihydro- 6H- phthalazino[1,2- b]quinazoline- 5,8- dione
Smiles: C#CCN1C(=O)c2ccccc2C2N1C(=O)c1c(N2CC#C)cccc1

STK687704
Synonyms: 6- (4- methoxyphenyl)- 3,7- dimethyl- 7H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine
Smiles: COc1ccc(cc1)C1=Nn2c(C)nnc2SC1C

STK687710
Synonyms: 2- bromo- 5- [(2,6- dimethylpiperidin- 1- yl)carbonyl]- N- phenylbenzenesulfonamide
Smiles: CC1CCCC(N1C(=O)c1ccc(c(c1)S(=O)(=O)Nc1ccccc1)Br)C

STK687719
Synonyms: 2- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccc(cc1)c1[nH]nc(c1)c1nn2c(n1)c1c(nc2)sc2c1CCC2

STK784171
Synonyms: 5- (4- chlorophenyl)- 4- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Clc1ccc(cc1)c1nnc(n1c1ccc2c(c1)OCCO2)S

STK784173
Synonyms: 2- chloro- 4- ({[(5- ethyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetyl}amino)benzoicacid
Smiles: CCc1nnc([nH]1)SCC(=O)Nc1ccc(c(c1)Cl)C(=O)O

STK687734
Synonyms: 1- (2- aminoethyl)- 5- [4- (dimethylamino)phenyl]- 3- hydroxy- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: NCCN1C(c2ccc(cc2)N(C)C)C(=C(C1=O)O)C(=O)c1ccccc1

STK687735
Synonyms: 4a,6,7,10- tetramethyl- 1,2,3,4,4a,10b- hexahydrophenanthridine
Smiles: Cc1ccc(c2c1C1CCCCC1(N=C2C)C)C

STK784179
Synonyms: (5E)- 5- {[7- methoxy- 2- (morpholin- 4- yl)quinolin- 3- yl]methylidene}- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1ccc2c(c1)nc(c(c2)/C=C\1/SC(=S)NC1=O)N1CCOCC1

STK687739
Synonyms: 3- (2- hydroxyethyl)- 1,5- dinitro- 2,3,4,5- tetrahydro- 1,5- methano- 3- benzazocin- 6(1H)- one
Smiles: OCCN1CC2(CC(C1)([N+](=O)[O-])c1c(C2=O)cccc1)[N+](=O)[O-]

STK687740
Synonyms: 1,7- bis(4- fluorophenyl)- 5,5- bis(trifluoromethyl)- 4a,5,8,8a- tetrahydropyrimido[4,5- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: Fc1ccc(cc1)C1=NC(C2C(N1)N(c1ccc(cc1)F)C(=O)NC2=O)(C(F)(F)F)C(F)(F)F

STK687742
Synonyms: 3- (2- hydroxyethyl)- 1,5- dinitro- 11- (2- oxo- 2- phenylethyl)- 2,3,4,5- tetrahydro- 1,5- methano- 3- benzazocin- 6(1H)- one
Smiles: OCCN1CC2([N+](=O)[O-])C(=O)c3c(C(C1)(C2CC(=O)c1ccccc1)[N+](=O)[O-])cccc3

STK687746
Synonyms: diethyl4- [4- (acetylamino)phenyl]- 2,6- diaminobenzo[1,2- b:4,5- b']difuran- 3,7- dicarboxylate
Smiles: CCOC(=O)c1c(N)oc2c1c(c1ccc(cc1)NC(=O)C)c1c(c2)c(c(o1)N)C(=O)OCC

STK687748
Synonyms: 3- [6- (2- chloroethoxy)- 1,5- dinitro- 3- azabicyclo[3.3.1]non- 6- en- 3- yl]propanoicacid
Smiles: ClCCOC1=CCC2(CC1(CN(C2)CCC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

STK687749
Synonyms: 3- [1,5- dinitro- 6- (piperidin- 1- ylcarbonyl)- 3- azabicyclo[3.3.1]non- 6- en- 3- yl]propanoicacid
Smiles: OC(=O)CCN1CC2(CC(C1)(CC=C2C(=O)N1CCCCC1)[N+](=O)[O-])[N+](=O)[O-]

STK687754
Synonyms: 3,3'- (cyclohexane- 1,2- diyldiimino)bis(5,5- dimethylcyclohex- 2- en- 1- one)
Smiles: O=C1C=C(NC2CCCCC2NC2=CC(=O)CC(C2)(C)C)CC(C1)(C)C

STK784181
Synonyms: 4- amino- 6- (dipropylamino)- N'- hydroxy- 1,3,5- triazine- 2- carboximidamide
Smiles: CCCN(c1nc(N)nc(n1)/C(=N\O)/N)CCC

STK784183
Synonyms: 4- amino- 6- (piperidin- 1- yl)- 1,3,5- triazine- 2- carbonitrile
Smiles: N#Cc1nc(N)nc(n1)N1CCCCC1

STK784184
Synonyms: 1- {1- [4- (dipropylamino)- 6- (1H- pyrrol- 1- yl)- 1,3,5- triazin- 2- yl]- 5- methyl- 1H- 1,2,3- triazol- 4- yl}ethanone
Smiles: CCCN(c1nc(nc(n1)n1cccc1)n1nnc(c1C)C(=O)C)CCC

STK784185
Synonyms: 4- amino- 6- [ethyl(phenyl)amino]- 1,3,5- triazine- 2- carbonitrile
Smiles: N#Cc1nc(N)nc(n1)N(c1ccccc1)CC

STK784191
Synonyms: 2- chloro- N- (4- ethylphenyl)- 4,6- dimethyl- 5- nitropyridine- 3- carboxamide
Smiles: CCc1ccc(cc1)NC(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])C

STK784200
Synonyms: 2- chloro- N,4,6- trimethyl- 5- nitro- N- phenylpyridine- 3- carboxamide
Smiles: O=C(c1c(Cl)nc(c(c1C)[N+](=O)[O-])C)N(c1ccccc1)C

STK784203
Synonyms: N- benzyl- 2- chloro- 4,6- dimethyl- 5- nitro- N- phenylpyridine- 3- carboxamide
Smiles: O=C(c1c(Cl)nc(c(c1C)[N+](=O)[O-])C)N(c1ccccc1)Cc1ccccc1

STK784207
Synonyms: 2- chloro- N- ethyl- 4,6- dimethyl- 5- nitro- N- phenylpyridine- 3- carboxamide
Smiles: CCN(C(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])C)c1ccccc1

STK784215
Synonyms: 3- amino- 4,5,6- trimethyl- N,N- di(prop- 2- en- 1- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: C=CCN(C(=O)c1sc2c(c1N)c(C)c(c(n2)C)C)CC=C

STK784216
Synonyms: 2- chloro- 4,6- dimethyl- 5- nitro- N- (2- phenylethyl)pyridine- 3- carboxamide
Smiles: O=C(c1c(Cl)nc(c(c1C)[N+](=O)[O-])C)NCCc1ccccc1

STK784217
Synonyms: 3- amino- N- [4- (diethylamino)phenyl]- 4,6- dimethylthieno[2,3- b]pyridine- 2- carboxamide
Smiles: CCN(c1ccc(cc1)NC(=O)c1sc2c(c1N)c(C)cc(n2)C)CC

STK687767
Synonyms: 5- nitro- 2- (4- oxo- 1,4- dihydro- 2H- 3,1- benzoxazin- 2- yl)benzoicacid
Smiles: OC(=O)c1cc(ccc1C1OC(=O)c2c(N1)cccc2)[N+](=O)[O-]

STK687768
Synonyms: N- acetyl- N'- [4,6- di(piperidin- 1- yl)- 1,3,5- triazin- 2- yl]- N'- methylacetohydrazide
Smiles: CC(=O)N(N(c1nc(nc(n1)N1CCCCC1)N1CCCCC1)C)C(=O)C

STK784223
Synonyms: ethyl2- [4- amino- 6- (piperidin- 1- yl)- 1,3,5- triazin- 2- yl]- 1,2- dihydro- 1,2,3,4- tetrazine- 5- carboxylate
Smiles: CCOC(=O)c1nnn([nH]c1)c1nc(N)nc(n1)N1CCCCC1

STK784224
Synonyms: N,N- diethyl- 6- (1,2,3,4- tetrazin- 2(1H)- yl)- 1,3,5- triazine- 2,4- diamine
Smiles: CCN(c1nc(N)nc(n1)n1nncc[nH]1)CC

STK784225
Synonyms: N- [2- (hydrazinylcarbonyl)- 4,6- dimethylthieno[2,3- b]pyridin- 3- yl]- 2- methoxybenzamide
Smiles: NNC(=O)c1sc2c(c1NC(=O)c1ccccc1OC)c(C)cc(n2)C

STK784228
Synonyms: 5- chloro- 3- {[(2- chlorophenyl)carbonyl]amino}- N- (4- ethylphenyl)- 4,6- dimethylthieno[2,3- b]pyridine- 2- carboxamide
Smiles: CCc1ccc(cc1)NC(=O)c1sc2c(c1NC(=O)c1ccccc1Cl)c(C)c(c(n2)C)Cl

STK784229
Synonyms: N- benzyl- 2- chloro- N- ethyl- 4,6- dimethyl- 5- nitropyridine- 3- carboxamide
Smiles: CCN(C(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])C)Cc1ccccc1

STK784231
Synonyms: 2,6- dichloro- N- [2- (3,4- diethoxyphenyl)ethyl]- 4- methylpyridine- 3- carboxamide
Smiles: CCOc1cc(CCNC(=O)c2c(C)cc(nc2Cl)Cl)ccc1OCC

STK784236
Synonyms: 7- methyl[1,3]thiazolo[4,5- b]pyridine- 2,5(3H,4H)- dione
Smiles: O=c1cc(C)c2c([nH]1)[nH]c(=O)s2

STK784237
Synonyms: 1,3'- diacetyl- 5'- (pyridin- 4- yl)- 3'H- spiro[indole- 3,2'- [1,3,4]oxadiazol]- 2(1H)- one
Smiles: CC(=O)N1N=C(OC21C(=O)N(c1c2cccc1)C(=O)C)c1ccncc1

STK784238
Synonyms: 5- acetyl- 4- amino- 1,2- oxazole- 3- carboxamide
Smiles: NC(=O)c1noc(c1N)C(=O)C

STK784239
Synonyms: 5- acetyl- 4- amino- N- phenyl- 1,2- oxazole- 3- carboxamide
Smiles: O=C(c1noc(c1N)C(=O)C)Nc1ccccc1

STK687779
Synonyms: diethyl(2Z,2'Z)- 2,2'- (6- methoxy- 4,4,5',5'- tetramethyl- 4,5- dihydro- 2'H- spiro[3- benzazepine- 7,3'- pyrrolidine]- 2,2'(3H)- diylidene)diethanoate
Smiles: CCOC(=O)/C=C\1/C=C2C=CC3(C(=C2CC(N1)(C)C)OC)CC(N/C/3=C\C(=O)OCC)(C)C

STK687781
Synonyms: methyl6- (3,4- dimethoxyphenyl)- 7- phenyl- 4,7- dihydrotetrazolo[1,5- a]pyrimidine- 5- carboxylate
Smiles: COC(=O)C1=C(c2ccc(c(c2)OC)OC)C(n2c(N1)nnn2)c1ccccc1

STK784246
Synonyms: (5Z)- 5- [(1- acetyl- 3- phenyl- 1H- pyrazol- 4- yl)methylidene]- 2- imino- 3- (1,3- thiazol- 2- yl)- 1,3- thiazolidin- 4- one
Smiles: N=C1S/C(=C\c2cn(nc2c2ccccc2)C(=O)C)/C(=O)N1c1nccs1

STK784248
Synonyms: 3'- acetyl- 5'- (thiophen- 2- yl)- 3'H- spiro[indole- 3,2'- [1,3,4]oxadiazol]- 2(1H)- one
Smiles: CC(=O)N1N=C(OC21C(=O)Nc1c2cccc1)c1cccs1

STK784251
Synonyms: 1- ethyl- 4- (1,2- oxazol- 5- yl)- N- [3- (trifluoromethyl)phenyl]- 1H- pyrazole- 5- carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1cccc(c1)C(F)(F)F)c1ccno1

STK784252
Synonyms: N- (2- carbamoylphenyl)- 1- ethyl- 4- (1,2- oxazol- 5- yl)- 1H- pyrazole- 5- carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1ccccc1C(=O)N)c1ccno1

STK784253
Synonyms: 8,10- dinitrobenzo[b][1,2,3]triazolo[4,5,1- jk][1,5]benzodiazepin- 7(6H)- one
Smiles: O=c1[nH]c2cccc3c2n(c2c1c(cc(c2)[N+](=O)[O-])[N+](=O)[O-])nn3

STK784254
Synonyms: N- (3,4- dimethoxybenzyl)- 1H- benzotriazol- 7- amine
Smiles: COc1cc(CNc2cccc3c2[nH]nn3)ccc1OC

STK784256
Synonyms: N- (3- ethoxy- 4- methoxybenzyl)- 1H- benzotriazol- 7- amine
Smiles: CCOc1cc(CNc2cccc3c2[nH]nn3)ccc1OC

STK784261
Synonyms: N,N'- di(2,3- dihydro- 1,4- benzodioxin- 6- yl)[1,2,5]oxadiazolo[3,4- b]pyrazine- 5,6- diamine
Smiles: C1COc2c(O1)cc(cc2)Nc1nc2nonc2nc1Nc1ccc2c(c1)OCCO2

STK687793
Synonyms: N- (4- {5- [3- (2- chlorophenyl)- 5- methyl- 1,2- oxazol- 4- yl]- 1,2,4- oxadiazol- 3- yl}phenyl)- 2- (4- nitro- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1ncc(c1)[N+](=O)[O-])Nc1ccc(cc1)c1noc(n1)c1c(C)onc1c1ccccc1Cl

STK784265
Synonyms: 4- (3- chloro- 4- fluorophenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Sc1nnc(n1c1ccc(c(c1)Cl)F)c1nccnc1

STK784270
Synonyms: 3- (4- chlorobenzyl)- 1- [3- (hexyloxy)phenyl]pyrrolidine- 2,5- dione
Smiles: CCCCCCOc1cccc(c1)N1C(=O)CC(C1=O)Cc1ccc(cc1)Cl

STK687795
Synonyms: methyl[1- (4,6- dimethylpyrimidin- 2- yl)- 5- oxo- 2,5- dihydro- 1H- pyrazol- 3- yl]acetate
Smiles: COC(=O)Cc1[nH]n(c(=O)c1)c1nc(C)cc(n1)C

STK784272
Synonyms: (1S,2S,5R)- 2- [5- (thiophen- 2- yl)- 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)n1nnnc1c1cccs1

STK784275
Synonyms: methyl2- (2- oxocyclohexyl)pyridine- 4- carboxylate
Smiles: COC(=O)c1ccnc(c1)C1CCCCC1=O

STK784276
Synonyms: N- (3- fluorophenyl)- 1H- benzimidazole- 6- carboxamide
Smiles: Fc1cccc(c1)NC(=O)c1ccc2c(c1)[nH]cn2

STK687802
Synonyms: 3,4- diphenyl- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: O=C1Oc2[nH]nc(c2C(C1)c1ccccc1)c1ccccc1

STK687803
Synonyms: 4- (3- methoxyphenyl)- 3- (4- methoxyphenyl)- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: COc1ccc(cc1)c1n[nH]c2c1C(CC(=O)O2)c1cccc(c1)OC

STK784288
Synonyms: 4- (4- nitrophenyl)- 3,4- dihydro- 2H,5H- pyrano[3,2- c]chromene- 2,5- dione
Smiles: O=C1CC(c2ccc(cc2)[N+](=O)[O-])c2c(O1)c1ccccc1oc2=O

STK784289
Synonyms: 4- (thiophen- 3- yl)- 3,4- dihydro- 2H,5H- pyrano[3,2- c]chromene- 2,5- dione
Smiles: O=C1CC(c2cscc2)c2c(O1)c1ccccc1oc2=O

STK784290
Synonyms: 4- (5- fluoro- 1H- indol- 3- yl)- 6- methyl- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: O=C1CC(c2c[nH]c3c2cc(F)cc3)c2c(O1)c1ccccc1n(c2=O)C

STK687806
Synonyms: N- [1- (2,4- dichlorobenzyl)- 1H- pyrazol- 3- yl]pyridine- 3- carboxamide
Smiles: Clc1ccc(c(c1)Cl)Cn1ccc(n1)NC(=O)c1cccnc1

STK784292
Synonyms: 3- phenyl- 4- (2,4,5- trimethoxyphenyl)- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: COc1cc(OC)c(cc1C1CC(=O)Oc2c1c(n[nH]2)c1ccccc1)OC

STK784298
Synonyms: ethyl5- hydroxy- 1- (4- methoxyphenyl)- 2- methyl- 4- (morpholin- 4- ylmethyl)- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1c(CN1CCOCC1)c(O)cc2)c1ccc(cc1)OC

STK784300
Synonyms: 1H- imidazo[4,5- d]pyridazine- 4,7- diol
Smiles: Oc1nnc(c2c1[nH]cn2)O

STK784301
Synonyms: N- [1- (2,4- dichlorobenzyl)- 1H- pyrazol- 3- yl]furan- 2- carboxamide
Smiles: Clc1ccc(c(c1)Cl)Cn1ccc(n1)NC(=O)c1ccco1

STK784302
Synonyms: N- [1- (2,4- dichlorobenzyl)- 1H- pyrazol- 3- yl]- 4- fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1ccn(n1)Cc1ccc(cc1Cl)Cl

STK784305
Synonyms: 1- (pyridin- 3- yl)- 1H- tetrazole- 5- thiol
Smiles: Sc1nnnn1c1cccnc1

STK784306
Synonyms: 4,7- dichloro- 1H- imidazo[4,5- d]pyridazine
Smiles: Clc1nnc(c2c1[nH]cn2)Cl

STK784308
Synonyms: N- [2- (1H- benzimidazol- 2- yl)ethyl]- 3- (thiophen- 2- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1cccs1)NCCc1nc2c([nH]1)cccc2

STK784309
Synonyms: N- [1- (2,4- dichlorobenzyl)- 3- methyl- 1H- pyrazol- 5- yl]- 1,3- benzodioxole- 5- carboxamide
Smiles: Clc1ccc(c(c1)Cl)Cn1nc(cc1NC(=O)c1ccc2c(c1)OCO2)C

STK784311
Synonyms: N- [1- (2,4- dichlorobenzyl)- 3- methyl- 1H- pyrazol- 5- yl]- 4- fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1cc(nn1Cc1ccc(cc1Cl)Cl)C

STK784313
Synonyms: N- [1- (2,4- dichlorobenzyl)- 3- methyl- 1H- pyrazol- 5- yl]furan- 2- carboxamide
Smiles: Clc1ccc(c(c1)Cl)Cn1nc(cc1NC(=O)c1ccco1)C

STK784314
Synonyms: 3- nitro- 1- benzofuran- 5- ol
Smiles: Oc1ccc2c(c1)c(co2)[N+](=O)[O-]

STK784315
Synonyms: 2- benzyl- 4,7- dichloro- 1- benzofuran- 5- ol
Smiles: Clc1c(O)cc(c2c1cc(o2)Cc1ccccc1)Cl

STK784318
Synonyms: 5- acetyl- 4- amino- N- benzyl- 1,2- oxazole- 3- carboxamide
Smiles: O=C(c1noc(c1N)C(=O)C)NCc1ccccc1

STK784319
Synonyms: 1- (difluoromethyl)- N- [3- (trifluoromethyl)phenyl]- 1H- pyrazole- 5- carboxamide
Smiles: O=C(c1ccnn1C(F)F)Nc1cccc(c1)C(F)(F)F

STK784321
Synonyms: N- (3- chlorophenyl)- 1- (difluoromethyl)- 1H- pyrazole- 5- carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1ccnn1C(F)F

STK784322
Synonyms: N- [2- (pyridin- 4- yl)ethyl]morpholine- 4- carboxamide
Smiles: O=C(N1CCOCC1)NCCc1ccncc1

STK784323
Synonyms: 1- [(1,3- dimethyl- 1H- pyrazol- 4- yl)sulfonyl]- N- [2- (4- methoxyphenyl)ethyl]piperidine- 4- carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)C1CCN(CC1)S(=O)(=O)c1cn(nc1C)C

STK687808
Synonyms: 2- {[6- amino- 4- oxo- 1- (2- phenylethyl)- 1,4- dihydropyrimidin- 2- yl]sulfanyl}- N- (2- cyanophenyl)propanamide
Smiles: N#Cc1ccccc1NC(=O)C(Sc1nc(=O)cc(n1CCc1ccccc1)N)C

STK687809
Synonyms: 4- [(3- acetyl- 6- methyl- 4- oxo- 4H- pyran- 2- yl)amino]- N- (1,3- thiazol- 2- yl)benzenesulfonamide
Smiles: Cc1oc(Nc2ccc(cc2)S(=O)(=O)Nc2nccs2)c(c(=O)c1)C(=O)C

STK784327
Synonyms: N- (1H- benzimidazol- 2- ylmethyl)- 3- [(4- nitro- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCc1nc2c([nH]1)cccc2

STK784329
Synonyms: 3- aminoquinoxalin- 2- ol
Smiles: Nc1nc2ccccc2nc1O

STK687811
Synonyms: ethyl7- methyl- 2- oxo- 1,1',2,2',5',6',7',7a'- octahydrospiro[indole- 3,3'- pyrrolizine]- 1'- carboxylate
Smiles: CCOC(=O)C1CC2(N3C1CCC3)C(=O)Nc1c2cccc1C

STK687812
Synonyms: ethyl5- methyl- 2- oxo- 1,1',2,2',5',6',7',7a'- octahydrospiro[indole- 3,3'- pyrrolizine]- 1'- carboxylate
Smiles: CCOC(=O)C1CC2(N3C1CCC3)C(=O)Nc1c2cc(C)cc1

STK784333
Synonyms: 2- ethoxy- 3- [3- (pyridin- 4- yl)- 1,2,4- oxadiazol- 5- yl]pyridine
Smiles: CCOc1ncccc1c1onc(n1)c1ccncc1

STK687813
Synonyms: 4- (4- {[(3,4- diethoxyphenyl)carbonyl]amino}- 1H- pyrazol- 1- yl)butanoicacid
Smiles: CCOc1cc(ccc1OCC)C(=O)Nc1cnn(c1)CCCC(=O)O

STK687814
Synonyms: 3- amino- 7- fluoro- 6- (morpholin- 4- yl)quinoxaline- 2- carboxamide
Smiles: Fc1cc2nc(C(=O)N)c(nc2cc1N1CCOCC1)N

STK687816
Synonyms: 3- amino- 7- fluoro- 6- [(2- hydroxyethyl)amino]quinoxaline- 2- carboxamide1,4- dioxide
Smiles: OCCNc1cc2c(cc1F)[n+]([O-])c(c([n+]2[O-])N)C(=O)N

STK687817
Synonyms: 4- methoxy- 7H- [1,3]thiazolo[3',2':1,2]pyrimido[5,4- c]quinolin- 7- one
Smiles: COc1cccc2c1ncc1c2nc2n(c1=O)ccs2

STK687818
Synonyms: 12- hydroxy- 4- methoxy- 7H- pyrido[1',2':1,2]pyrimido[5,4- c]quinolin- 7- one
Smiles: COc1cccc2c1ncc1c2nc2n(c1=O)cccc2O

STK687819
Synonyms: N- {4- [5- (furan- 2- yl)- 1,2,4- oxadiazol- 3- yl]phenyl}- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])Nc1ccc(cc1)c1noc(n1)c1ccco1

STK784341
Synonyms: N- [4- (4- chloro- 1H- pyrazol- 1- yl)phenyl]- 3,4- diethoxybenzamide
Smiles: CCOc1cc(ccc1OCC)C(=O)Nc1ccc(cc1)n1ncc(c1)Cl

STK687820
Synonyms: N- [4- (4- chloro- 1H- pyrazol- 1- yl)phenyl]- 1,3- benzodioxole- 5- carboxamide
Smiles: Clc1cnn(c1)c1ccc(cc1)NC(=O)c1ccc2c(c1)OCO2

STK784342
Synonyms: N- [4- (4- chloro- 1H- pyrazol- 1- yl)phenyl]- 3- (4- methoxyphenyl)propanamide
Smiles: COc1ccc(cc1)CCC(=O)Nc1ccc(cc1)n1ncc(c1)Cl

STK784343
Synonyms: 2- (4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- [4- (4- chloro- 1H- pyrazol- 1- yl)phenyl]acetamide
Smiles: O=C(Cn1nc(c(c1C)Br)C)Nc1ccc(cc1)n1ncc(c1)Cl

STK687821
Synonyms: 8- amino- 5- (4- hydroxyphenyl)- 4- oxo- 1,3,4,5,10,11- hexahydro- 2H,9H- 9,12- ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2- a]quinoline- 6- carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1ccc(cc1)O)C(=O)CCC2)sc1c3C2CCN1CC2

STK784344
Synonyms: 5- (4- fluorophenyl)- 1,3- dimethyl- 5,8- dihydropyrido[2,3- d]pyrimidine- 2,4,7(1H,3H,6H)- trione
Smiles: O=C1CC(c2ccc(cc2)F)c2c(N1)n(C)c(=O)n(c2=O)C

STK687822
Synonyms: 4- (2,3- dimethoxyphenyl)- 3- (4- methoxyphenyl)- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: COc1ccc(cc1)c1n[nH]c2c1C(CC(=O)O2)c1cccc(c1OC)OC

STK784349
Synonyms: 4- (2,3- dimethoxyphenyl)- 3- (3- nitrophenyl)- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: COc1c(OC)cccc1C1CC(=O)Oc2c1c(n[nH]2)c1cccc(c1)[N+](=O)[O-]

STK784351
Synonyms: 3- phenyl- 4- (3,4,5- trimethoxyphenyl)- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)Oc2c1c(n[nH]2)c1ccccc1

STK784353
Synonyms: 3- (4- methoxyphenyl)- 4- [4- (trifluoromethyl)phenyl]- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: COc1ccc(cc1)c1n[nH]c2c1C(CC(=O)O2)c1ccc(cc1)C(F)(F)F

STK784356
Synonyms: 4- {4- [(2- chlorobenzyl)oxy]phenyl}- 3- (3- nitrophenyl)- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: O=C1CC(c2ccc(cc2)OCc2ccccc2Cl)c2c(O1)[nH]nc2c1cccc(c1)[N+](=O)[O-]

STK687823
Synonyms: 4- [benzyl(methyl)amino]- 1- oxaspiro[4.5]dec- 3- en- 2- one
Smiles: CN(C1=CC(=O)OC21CCCCC2)Cc1ccccc1

STK687824
Synonyms: N- {4- [(5Z)- 2- imino- 4- oxo- 5- {[1- phenyl- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1H- pyrazol- 4- yl]methylidene}- 1,3- thiazolidin- 3- yl]- 1,2,5- oxadiazol- 3- yl}acetamide
Smiles: CC(=O)Nc1nonc1N1C(=N)S/C(=C\c2cn(nc2C23CC4CC(C3)CC(C2)C4)c2ccccc2)/C1=O

STK784365
Synonyms: 3- acetyl- 2- [(4- acetylphenyl)amino]- 6- methyl- 4H- pyran- 4- one
Smiles: Cc1cc(=O)c(c(o1)Nc1ccc(cc1)C(=O)C)C(=O)C

STK784367
Synonyms: methyl2- benzyl- 7- [(tetrahydrofuran- 3- ylcarbonyl)amino]- 1,3- benzoxazole- 5- carboxylate
Smiles: COC(=O)c1cc(NC(=O)C2CCOC2)c2c(c1)nc(o2)Cc1ccccc1

STK784369
Synonyms: methyl2- benzyl- 7- [(2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)amino]- 1,3- benzoxazole- 5- carboxylate
Smiles: COC(=O)c1cc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c2c(c1)nc(o2)Cc1ccccc1

STK687829
Synonyms: N- (2- phenylethyl)ethane- 1,2- diamine
Smiles: NCCNCCc1ccccc1

STK687830
Synonyms: methyl6- bromonaphthalene- 2- carboxylate
Smiles: COC(=O)c1ccc2c(c1)ccc(c2)Br

STK687832
Synonyms: 2,6- bis{[4- (4- methoxyphenyl)piperazin- 1- yl]methyl}- 3,7- diphenyltetrahydro- 1H,5H- [1,2,4]triazolo[1,2- a][1,2,4]triazole- 1,5- dithione
Smiles: COc1ccc(cc1)N1CCN(CC1)CN1C(=S)N2N(C1c1ccccc1)C(=S)N(C2c1ccccc1)CN1CCN(CC1)c1ccc(cc1)OC

STK687836
Synonyms: 4,5- bis(4- methoxyphenyl)- 1- phenyl- 1H- imidazole- 2- thiol
Smiles: COc1ccc(cc1)c1c(nc(n1c1ccccc1)S)c1ccc(cc1)OC

STK687842
Synonyms: 4- acetyl- 1- (2- ethylhexyl)- 3- hydroxy- 5- (4- methylphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCCCC(CN1C(c2ccc(cc2)C)C(=C(C1=O)O)C(=O)C)CC

STK687850
Synonyms: 4- [(4- fluorophenyl)carbonyl]- 3- hydroxy- 1- {2- [(2- hydroxyethyl)amino]ethyl}- 5- (4- hydroxy- 3- methoxyphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: OCCNCCN1C(c2ccc(c(c2)OC)O)C(=C(C1=O)O)C(=O)c1ccc(cc1)F

STK784378
Synonyms: 4- ({[(7,8- dimethoxyphthalazin- 1- yl)sulfanyl]acetyl}amino)benzoicacid
Smiles: COc1c(OC)ccc2c1c(nnc2)SCC(=O)Nc1ccc(cc1)C(=O)O

STK687855
Synonyms: (1S,5R)- N- [1- (4- chlorophenyl)ethyl]- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocine- 3(4H)- carbothioamide
Smiles: Clc1ccc(cc1)C(NC(=S)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C

STK784386
Synonyms: 5- [2- (morpholin- 4- yl)ethyl]- 1,3,4- thiadiazol- 2- amine
Smiles: Nc1nnc(s1)CCN1CCOCC1

STK687860
Synonyms: 3- hydroxy- 1- (naphthalen- 1- ylmethyl)- 3- (2- oxocycloheptyl)- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1CCCCCC1C1(O)c2ccccc2N(C1=O)Cc1cccc2c1cccc2

STK784393
Synonyms: 3- (3,5- dimethoxyphenyl)- 6- (furan- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1cc(OC)cc(c1)c1nnc2n1nc(s2)c1ccco1

STK687865
Synonyms: methylN- {[(1S,5R)- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl]carbonothioyl}methioninate
Smiles: CSCCC(C(=O)OC)NC(=S)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

STK687866
Synonyms: 9- chloro- N,N- dimethyl- 6- oxo- 6H- pyrido[1,2- a]quinazoline- 8- sulfonamide
Smiles: Clc1cc2c(cc1S(=O)(=O)N(C)C)c(=O)nc1n2cccc1

STK687873
Synonyms: 2,6- dimethyl- N- (6,7,8,9- tetrahydro- 5H- [1,2,4]triazolo[4,3- a]azepin- 3- ylmethyl)aniline
Smiles: Cc1cccc(c1NCc1nnc2n1CCCCC2)C

STK687875
Synonyms: 3- [(2,5- dichlorophenyl)amino]- 6- methyl- 1,2,4- triazin- 5(4H)- one
Smiles: Clc1ccc(c(c1)Nc1nnc(c(=O)[nH]1)C)Cl

STK687887
Synonyms: 6- chloro- 4,5- dicyano- 2- [(cyclohexylideneamino)oxy]- 3,3- dimethyl- 1,2,3,4- tetrahydropyridine- 4- carboxamide
Smiles: N#CC1=C(Cl)NC(C(C1(C#N)C(=O)N)(C)C)ON=C1CCCCC1

STK784401
Synonyms: 8,10- diamino- 7- phenyl- 7H- benzo[7,8]chromeno[2,3- b]pyridine- 9- carbonitrile
Smiles: N#Cc1c(N)nc2c(c1N)C(c1ccccc1)c1c(O2)c2ccccc2cc1

STK784403
Synonyms: N- [4- (5- ethyl- 1,2,4- oxadiazol- 3- yl)- 1,2,5- oxadiazol- 3- yl]propanamide
Smiles: CCC(=O)Nc1nonc1c1noc(n1)CC

STK687898
Synonyms: 4- (4- {[2- (4- chloro- 2- methylphenoxy)propanoyl]amino}- 1H- pyrazol- 1- yl)butanoicacid
Smiles: OC(=O)CCCn1ncc(c1)NC(=O)C(Oc1ccc(cc1C)Cl)C

STK687899
Synonyms: 4- (4- {[(2- methylphenoxy)acetyl]amino}- 1H- pyrazol- 1- yl)butanoicacid
Smiles: O=C(Nc1cnn(c1)CCCC(=O)O)COc1ccccc1C

STK784409
Synonyms: N- [3- (morpholin- 4- yl)propyl]- 3- [(4- nitro- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCCCN1CCOCC1

STK784416
Synonyms: 3- (pyrimidin- 5- yl)prop- 2- yn- 1- ol
Smiles: OCC#Cc1cncnc1

STK687901
Synonyms: ethyl4- acetyl- 5- methyl- 2- {[(2- oxo- 1,3- benzothiazol- 3(2H)- yl)acetyl]amino}furan- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)Cn2c(=O)sc3c2cccc3)oc(c1C(=O)C)C

STK784417
Synonyms: 1- ethyl- 4- (1,2- oxazol- 5- yl)- N- [4- (trifluoromethyl)phenyl]- 1H- pyrazole- 5- carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1ccc(cc1)C(F)(F)F)c1ccno1

STK687902
Synonyms: N- (4- chlorophenyl)- 1- ethyl- 4- (1,2- oxazol- 5- yl)- 1H- pyrazole- 5- carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1ccc(cc1)Cl)c1ccno1

STK687903
Synonyms: N- (3- chlorophenyl)- 1- ethyl- 4- (1,2- oxazol- 5- yl)- 1H- pyrazole- 5- carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1cccc(c1)Cl)c1ccno1

STK687904
Synonyms: 1- (difluoromethyl)- N- (3,4- dimethoxybenzyl)- 1H- pyrazole- 5- carboxamide
Smiles: COc1cc(CNC(=O)c2ccnn2C(F)F)ccc1OC

STK687905
Synonyms: 5H- isoindolo[1,2- b][1,3,4]benzotriazepin- 8(7H)- one
Smiles: O=c1[nH]n2Cc3c(c2nc2c1cccc2)cccc3

STK784418
Synonyms: 1- [(1,3- dimethyl- 1H- pyrazol- 4- yl)sulfonyl]- N- (4- fluorophenyl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)S(=O)(=O)c1cn(nc1C)C)Nc1ccc(cc1)F

STK784419
Synonyms: 1- [(1,3- dimethyl- 1H- pyrazol- 4- yl)sulfonyl]- N- (4- methoxyphenyl)piperidine- 4- carboxamide
Smiles: COc1ccc(cc1)NC(=O)C1CCN(CC1)S(=O)(=O)c1cn(nc1C)C

STK784420
Synonyms: 5- amino- 1,3- dimethyl- 6- (piperidin- 1- yl)- 1,3- dihydro- 2H- benzimidazol- 2- one
Smiles: Nc1cc2c(cc1N1CCCCC1)n(c(=O)n2C)C

STK687907
Synonyms: ethyl(2Z,4Z,7Z)- 2,4,7- trihydroxy- 6,9- dioxodeca- 2,4,7- trienoate
Smiles: CCOC(=O)/C(=C/C(=C/C(=O)/C(=C/C(=O)C)/O)/O)/O

STK784428
Synonyms: 2,9- dichloro- 8- [(3- methylpiperidin- 1- yl)sulfonyl]- 6H- pyrido[1,2- a]quinazolin- 6- one
Smiles: CC1CCCN(C1)S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)cc(cc3)Cl

STK784430
Synonyms: methyl4- {5- methyl- 3- [(pyrazin- 2- ylcarbonyl)amino]- 1H- pyrazol- 1- yl}butanoate
Smiles: COC(=O)CCCn1nc(cc1C)NC(=O)c1cnccn1

STK784431
Synonyms: N- methyl- 8- (morpholin- 4- yl)- 5- oxo- N- phenyl- 5H- [1,3]thiazolo[3,2- a]quinazoline- 7- sulfonamide
Smiles: O=c1nc2sccn2c2c1cc(c(c2)N1CCOCC1)S(=O)(=O)N(c1ccccc1)C

STK784433
Synonyms: 8- chloro- 7- (piperidin- 1- ylsulfonyl)- 5H- [1,3]thiazolo[3,2- a]quinazolin- 5- one
Smiles: Clc1cc2c(cc1S(=O)(=O)N1CCCCC1)c(=O)nc1n2ccs1

STK784437
Synonyms: methyl2- [(ethoxycarbonyl)amino]- 3,3,3- trifluoro- N- 1,3- thiazol- 2- ylalaninate
Smiles: CCOC(=O)NC(C(F)(F)F)(C(=O)OC)Nc1nccs1

STK784438
Synonyms: 2,9- dimethyl- 7H- [1,3]oxazolo[5',4':3,4]pyrido[1,2- a]pyrimidin- 7- one
Smiles: Cc1nc2c(o1)c1nc(C)cc(=O)n1cc2

STK784442
Synonyms: ethyl(5- {[(2- ethoxypyridin- 3- yl)carbonyl]amino}- 3- methyl- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1nc(cc1NC(=O)c1cccnc1OCC)C

STK784443
Synonyms: 3- (1,3- benzodioxol- 5- yl)- N- [3- (morpholin- 4- yl)propyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)OCO2)NCCCN1CCOCC1

STK784444
Synonyms: N- [3- (morpholin- 4- yl)propyl]- 3- [(3- nitro- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1ccc(n1)[N+](=O)[O-])NCCCN1CCOCC1

STK784446
Synonyms: 1- methyl- 4- nitro- 1H- benzo[b]furo[4,3,2- ef][1]benzoxepine
Smiles: CC1Oc2c3C1=Cc1ccccc1Oc3cc(c2)[N+](=O)[O-]

STK784447
Synonyms: 3'- acetyl- 5'- cyclopropyl- 3'H- spiro[indole- 3,2'- [1,3,4]oxadiazol]- 2(1H)- one
Smiles: CC(=O)N1N=C(OC21C(=O)Nc1c2cccc1)C1CC1

STK687909
Synonyms: 4- (pyridin- 2- yl)- 1,3,4,5- tetrahydro- 2H- indeno[1,2- d]pyrimidin- 2- one
Smiles: O=C1NC(c2ccccn2)C2=C(N1)c1ccccc1C2

STK784449
Synonyms: 8- (benzyloxy)- 1- methyl- 4- nitro- 1H- benzo[b]furo[4,3,2- ef][1]benzoxepine
Smiles: CC1Oc2c3C1=Cc1ccc(cc1Oc3cc(c2)[N+](=O)[O-])OCc1ccccc1

STK784451
Synonyms: 4- (3,5- dibromo- 4- nitrosophenyl)morpholine
Smiles: O=Nc1c(Br)cc(cc1Br)N1CCOCC1

STK687912
Synonyms: 4- bromo- 6- (morpholin- 4- yl)- 2,1,3- benzoxadiazole
Smiles: Brc1cc(cc2c1non2)N1CCOCC1

STK784455
Synonyms: 3- bromo- 5- [(2- methoxyethyl)amino]- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: COCCNc1cc(Br)c2c3c1C(=O)c1ccccc1c3on2

STK687913
Synonyms: 3- bromo- 5- {[3- (dimethylamino)propyl]amino}- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: CN(CCCNc1cc(Br)c2c3c1C(=O)c1ccccc1c3on2)C

STK784457
Synonyms: 3- [(4- methylphenyl)sulfonyl]- 8- nitro- 2'- thioxo- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 4',6'(1'H,3'H)- dione
Smiles: S=C1NC(=O)C2(C(=O)N1)Cc1cc(ccc1N1C2CN(CC1)S(=O)(=O)c1ccc(cc1)C)[N+](=O)[O-]

STK784459
Synonyms: 7- chloro- 2- (4- ethoxy- 3- methoxyphenyl)- 3- hydroxy- 4H- chromen- 4- one
Smiles: CCOc1ccc(cc1OC)c1oc2cc(Cl)ccc2c(=O)c1O

STK784461
Synonyms: ethyl(4- {[3- (1,3- benzodioxol- 5- yl)- 3- oxopropyl]amino}phenyl)acetate
Smiles: CCOC(=O)Cc1ccc(cc1)NCCC(=O)c1ccc2c(c1)OCO2

STK784462
Synonyms: 7- methyl[1,2,4]triazolo[4,3- a]pyrimidin- 5- ol
Smiles: Cc1cc(O)n2c(n1)nnc2

STK687917
Synonyms: 2- (4- chlorophenyl)- 6,7- dihydro- 5H- [1,2,4]triazolo[5,1- b][1,3]thiazine
Smiles: Clc1ccc(cc1)c1nn2c(n1)SCCC2

STK687918
Synonyms: 2- (diethylamino)ethyl4- {[3- (4- methoxyphenyl)- 3- oxopropyl]amino}benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)NCCC(=O)c1ccc(cc1)OC)CC

STK687919
Synonyms: 2- (diethylamino)ethyl4- {[3- (furan- 2- yl)- 3- oxopropyl]amino}benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)NCCC(=O)c1ccco1)CC

STK687920
Synonyms: 4- {2- [({5- chloro- 2- [2- (morpholin- 4- yl)- 2- oxoethoxy]phenyl}sulfonyl)amino]ethoxy}benzoicacid
Smiles: Clc1ccc(c(c1)S(=O)(=O)NCCOc1ccc(cc1)C(=O)O)OCC(=O)N1CCOCC1

STK687923
Synonyms: 3- [(4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- N- [3- (dimethylamino)propyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CN(CCCNC(=O)c1onc(n1)Cn1nc(c(c1C)Br)C)C

STK687924
Synonyms: 3- [(4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- N- [2- (diethylamino)ethyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CCN(CCNC(=O)c1onc(n1)Cn1nc(c(c1C)Br)C)CC

STK784465
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- [(3- nitro- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazole
Smiles: [O-][N+](=O)c1ccn(n1)Cc1onc(n1)c1ccc2c(c1)OCO2

STK784466
Synonyms: 1- methyl- 3- propyl- N- [4- (pyridin- 4- ylmethyl)phenyl]- 1H- pyrazole- 5- carboxamide
Smiles: CCCc1nn(c(c1)C(=O)Nc1ccc(cc1)Cc1ccncc1)C

STK687927
Synonyms: 1- methyl- N- [4- (morpholin- 4- ylcarbonyl)phenyl]- 3- propyl- 1H- pyrazole- 5- carboxamide
Smiles: CCCc1nn(c(c1)C(=O)Nc1ccc(cc1)C(=O)N1CCOCC1)C

STK687928
Synonyms: 7- methyl- 5- (morpholin- 4- yl)[1,2,4]triazolo[4,3- a]pyrimidine
Smiles: Cc1cc(N2CCOCC2)n2c(n1)nnc2

STK784470
Synonyms: ethyl(3- {[(4- fluorophenyl)carbonyl]amino}- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1ccc(n1)NC(=O)c1ccc(cc1)F

STK784471
Synonyms: methyl4- (3- {[(4- fluorophenyl)carbonyl]amino}- 5- methyl- 1H- pyrazol- 1- yl)butanoate
Smiles: COC(=O)CCCn1nc(cc1C)NC(=O)c1ccc(cc1)F

STK784472
Synonyms: methyl4- {3- [(1,3- benzodioxol- 5- ylcarbonyl)amino]- 5- methyl- 1H- pyrazol- 1- yl}butanoate
Smiles: COC(=O)CCCn1nc(cc1C)NC(=O)c1ccc2c(c1)OCO2

STK687931
Synonyms: N- {[3- amino- 6- (pyridin- 3- yl)- 4- (trifluoromethyl)thieno[2,3- b]pyridin- 2- yl]carbonyl}glycine
Smiles: OC(=O)CNC(=O)c1sc2c(c1N)c(cc(n2)c1cccnc1)C(F)(F)F

STK784475
Synonyms: methyl3- [3- (4- amino- 1,2,5- oxadiazol- 3- yl)- 1,2,4- oxadiazol- 5- yl]propanoate
Smiles: COC(=O)CCc1nc(no1)c1nonc1N

STK687933
Synonyms: 5- {4- [4- (ethoxycarbonyl)piperidin- 1- yl]- 1,2,5- oxadiazol- 3- yl}[1,2,3]triazolo[4,5- c][1,2,5]oxadiazol- 5- ium- 4- ide
Smiles: CCOC(=O)C1CCN(CC1)c1nonc1[n+]1nc2c([n-]1)non2

STK784477
Synonyms: N- (2- phenylethyl)- 2- (7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 3- ylsulfanyl)acetamide
Smiles: O=C(CSc1nnc2n1nc[nH]2)NCCc1ccccc1

STK784478
Synonyms: [1- (pyridin- 3- yl)- 1H- 1,2,3- triazole- 4,5- diyl]dimethanol
Smiles: OCc1c(CO)nnn1c1cccnc1

STK687935
Synonyms: diethyl(2E)- 2- [(2,3,5- trimethyl- 1H- indol- 6- yl)amino]but- 2- enedioate
Smiles: CCOC(=O)/C(=C\C(=O)OCC)/Nc1cc2[nH]c(c(c2cc1C)C)C

STK687936
Synonyms: diethyl(2E)- 2- [(2,3- dimethyl- 1H- indol- 5- yl)amino]but- 2- enedioate
Smiles: CCOC(=O)/C(=C\C(=O)OCC)/Nc1ccc2c(c1)c(C)c([nH]2)C

STK687937
Synonyms: diethyl(2E)- 2- [(6- methyl- 2- phenyl- 1H- indol- 5- yl)amino]but- 2- enedioate
Smiles: CCOC(=O)/C(=C\C(=O)OCC)/Nc1cc2cc([nH]c2cc1C)c1ccccc1

STK687939
Synonyms: diethyl(2E)- 2- [(6- methoxy- 2,3- dimethyl- 1H- indol- 5- yl)amino]but- 2- enedioate
Smiles: CCOC(=O)/C(=C\C(=O)OCC)/Nc1cc2c(cc1OC)[nH]c(c2C)C

STK687940
Synonyms: diethyl(2E)- 2- [(2,3,6- trimethyl- 1H- indol- 5- yl)amino]but- 2- enedioate
Smiles: CCOC(=O)/C(=C\C(=O)OCC)/Nc1cc2c(cc1C)[nH]c(c2C)C

STK784481
Synonyms: 5- methoxy- 1,2,7,9- tetramethyl- 3H- pyrrolo[3,2- f]quinoline
Smiles: COc1cc2[nH]c(c(c2c2c1nc(C)cc2C)C)C

STK687941
Synonyms: ethyl5- [(diethylamino)methyl]- 1- (4- phenyl- 1,2,5- oxadiazol- 3- yl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CN(CC)CC)c1nonc1c1ccccc1

STK687942
Synonyms: methyl4- [(5- chloro- 2,4- dimethoxyphenyl)amino]- 4- oxo- 3- (piperidin- 1- yl)butanoate
Smiles: COC(=O)CC(C(=O)Nc1cc(Cl)c(cc1OC)OC)N1CCCCC1

STK687944
Synonyms: 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (4- fluorobenzyl)- 4H- 1,2,4- triazol- 4- amine
Smiles: Fc1ccc(cc1)CNn1cnnc1n1nc(cc1C)C

STK784485
Synonyms: 6,6- dimethyl- 9- (thiophen- 2- yl)- 6,7,9,10- tetrahydro- 4H- [1,2,5]oxadiazolo[3,4- b][1,4]benzodiazepin- 8(5H)- one
Smiles: O=C1CC(C)(C)CC2=C1C(Nc1c(N2)non1)c1cccs1

STK784486
Synonyms: 9- (3- ethoxy- 4- hydroxyphenyl)- 6,6- dimethyl- 6,7,9,10- tetrahydro- 4H- [1,2,5]oxadiazolo[3,4- b][1,4]benzodiazepin- 8(5H)- one
Smiles: CCOc1cc(ccc1O)C1Nc2nonc2NC2=C1C(=O)CC(C2)(C)C

STK784488
Synonyms: 2- {[5- (4- hydroxybenzyl)- 4- methyl- 1H- imidazol- 2- yl]sulfanyl}- N- (4,5,6,7- tetrahydro- 1,3- benzothiazol- 2- yl)acetamide
Smiles: Oc1ccc(cc1)Cc1[nH]c(nc1C)SCC(=O)Nc1nc2c(s1)CCCC2

STK784489
Synonyms: N- [2- chloro- 4- (morpholin- 4- yl)phenyl]- 6- methyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidine- 5- sulfonamide
Smiles: Clc1cc(ccc1NS(=O)(=O)c1c(C)[nH]c(=O)[nH]c1=O)N1CCOCC1

STK784491
Synonyms: methyl3- [(5- chloro- 2- methoxyphenyl)carbamoyl]- 1- methyl- 1H- pyrazole- 5- carboxylate
Smiles: COC(=O)c1cc(nn1C)C(=O)Nc1cc(Cl)ccc1OC

STK784493
Synonyms: methyl3- [(2,4- dichlorophenyl)carbamoyl]- 1- methyl- 1H- pyrazole- 5- carboxylate
Smiles: COC(=O)c1cc(nn1C)C(=O)Nc1ccc(cc1Cl)Cl

STK784494
Synonyms: 7- chloro- 6- methyl[1,2,4]triazolo[1,5- b]pyridazin- 8- ol
Smiles: Cc1nn2ncnc2c(c1Cl)O

STK784495
Synonyms: 3- amino- N- [2- (1H- indol- 3- yl)ethyl]- 6- (pyridin- 3- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)ccc(n2)c1cccnc1)NCCc1c[nH]c2c1cccc2

STK784496
Synonyms: 8- chloro- 7- [(6- chloropyridin- 3- yl)methyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1ccc(cn1)Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C

STK784499
Synonyms: 4- {4- [(4- fluorobenzyl)oxy]phenyl}- 3,4- dihydro- 2H- pyrido[3,2- e][1,3]thiazolo[3,2- a]pyrimidine- 2,5(1H)- dione
Smiles: O=C1CC(c2ccc(cc2)OCc2ccc(cc2)F)c2c(N1)n1ccsc1nc2=O

STK784501
Synonyms: 4- (3,4- dimethoxyphenyl)- 3- (4- methoxyphenyl)- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: COc1ccc(cc1)c1n[nH]c2c1C(CC(=O)O2)c1ccc(c(c1)OC)OC

STK784502
Synonyms: 4- (3,4- dimethoxyphenyl)- 3- (3- nitrophenyl)- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: COc1cc(ccc1OC)C1CC(=O)Oc2c1c(n[nH]2)c1cccc(c1)[N+](=O)[O-]

STK784503
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 3- (3- nitrophenyl)- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: O=C1Oc2[nH]nc(c2C(C1)c1ccc2c(c1)OCO2)c1cccc(c1)[N+](=O)[O-]

STK784509
Synonyms: 1- [4- (4- fluorophenyl)- 2,5- dioxo- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl]- 4,6- dimethyl- 2- oxo- 1,2- dihydropyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(n(c1=O)N1C(=O)CC(C2=C1CCCC2=O)c1ccc(cc1)F)C

STK784510
Synonyms: 1- [2,5- dioxo- 4- (3,4,5- trimethoxyphenyl)- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl]- 4,6- dimethyl- 2- oxo- 1,2- dihydropyridine- 3- carbonitrile
Smiles: COc1c(OC)cc(cc1OC)C1CC(=O)N(C2=C1C(=O)CCC2)n1c(C)cc(c(c1=O)C#N)C

STK784511
Synonyms: 1- [4- (4- hydroxy- 3- methoxyphenyl)- 2,5- dioxo- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl]- 4,6- dimethyl- 2- oxo- 1,2- dihydropyridine- 3- carbonitrile
Smiles: COc1cc(ccc1O)C1CC(=O)N(C2=C1C(=O)CCC2)n1c(C)cc(c(c1=O)C#N)C

STK687946
Synonyms: 4- (4- {[(4- ethoxyphenyl)carbonyl]amino}- 1H- pyrazol- 1- yl)butanoicacid
Smiles: CCOc1ccc(cc1)C(=O)Nc1cnn(c1)CCCC(=O)O

STK784512
Synonyms: 5- [1- phenyl- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1H- pyrazol- 4- yl]- 1,3,4- oxadiazol- 2- amine
Smiles: Nc1nnc(o1)c1cn(nc1C12CC3CC(C2)CC(C1)C3)c1ccccc1

STK784513
Synonyms: 5- hydroxy- 6,7- dimethyl[1,3]thiazolo[4,5- b]pyridin- 2(3H)- one
Smiles: Oc1nc2[nH]c(=O)sc2c(c1C)C

STK784514
Synonyms: ethyl(3- {[(4- fluorophenoxy)acetyl]amino}- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1ccc(n1)NC(=O)COc1ccc(cc1)F

STK784515
Synonyms: ethyl(3- {[(2,4- difluorophenoxy)acetyl]amino}- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1ccc(n1)NC(=O)COc1ccc(cc1F)F

STK687948
Synonyms: ethyl{3- [(furan- 2- ylcarbonyl)amino]- 1H- pyrazol- 1- yl}acetate
Smiles: CCOC(=O)Cn1ccc(n1)NC(=O)c1ccco1

STK784518
Synonyms: methyl4- (3- {[(4- fluorophenoxy)acetyl]amino}- 5- methyl- 1H- pyrazol- 1- yl)butanoate
Smiles: COC(=O)CCCn1nc(cc1C)NC(=O)COc1ccc(cc1)F

STK784519
Synonyms: methyl4- {3- [(furan- 2- ylcarbonyl)amino]- 5- methyl- 1H- pyrazol- 1- yl}butanoate
Smiles: COC(=O)CCCn1nc(cc1C)NC(=O)c1ccco1

STK784520
Synonyms: methyl4- {5- methyl- 3- [(pyridin- 3- ylcarbonyl)amino]- 1H- pyrazol- 1- yl}butanoate
Smiles: COC(=O)CCCn1nc(cc1C)NC(=O)c1cccnc1

STK784521
Synonyms: methyl4- {5- methyl- 3- [(pyridin- 4- ylcarbonyl)amino]- 1H- pyrazol- 1- yl}butanoate
Smiles: COC(=O)CCCn1nc(cc1C)NC(=O)c1ccncc1

STK687949
Synonyms: 7- amino- 3- tert- butyl- 4- oxo- 1,4- dihydropyrazolo[5,1- c][1,2,4]triazine- 8- carbonitrile
Smiles: N#Cc1c(N)nn2c1[nH]nc(c2=O)C(C)(C)C

STK687951
Synonyms: (1Z)- 1- (3- hydroxypyrido[2,3- b]pyrazin- 2(1H)- ylidene)propan- 2- one
Smiles: CC(=O)/C=c/1\[nH]c2cccnc2nc1O

STK687952
Synonyms: 2- (1,3- benzodioxol- 5- yloxy)pyridine- 3- carboxylicacid
Smiles: OC(=O)c1cccnc1Oc1ccc2c(c1)OCO2

STK687953
Synonyms: 2- {[5- (4- amino- 1,2,5- oxadiazol- 3- yl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- benzylacetamide
Smiles: CCn1c(SCC(=O)NCc2ccccc2)nnc1c1nonc1N

STK687960
Synonyms: N- benzyl- 4- [(chloroacetyl)amino]- 5- (phenylcarbonyl)- 1,2- oxazole- 3- carboxamide
Smiles: ClCC(=O)Nc1c(noc1C(=O)c1ccccc1)C(=O)NCc1ccccc1

STK687961
Synonyms: 4- [(chloroacetyl)amino]- N- methyl- 5- (phenylcarbonyl)- 1,2- oxazole- 3- carboxamide
Smiles: ClCC(=O)Nc1c(onc1C(=O)NC)C(=O)c1ccccc1

STK687962
Synonyms: 4- [(chloroacetyl)amino]- 5- (phenylcarbonyl)- 1,2- oxazole- 3- carboxamide
Smiles: ClCC(=O)Nc1c(onc1C(=O)N)C(=O)c1ccccc1

STK784525
Synonyms: ethyl[3- methyl- 5- ({[3- (trifluoromethyl)phenoxy]acetyl}amino)- 1H- pyrazol- 1- yl]acetate
Smiles: CCOC(=O)Cn1nc(cc1NC(=O)COc1cccc(c1)C(F)(F)F)C

STK687965
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- (3- fluorophenyl)- 1,2,4- oxadiazole
Smiles: Fc1cccc(c1)c1onc(n1)c1ccc2c(c1)OCO2

STK784527
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (2- fluorobenzyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)NCc1ccccc1F

STK687967
Synonyms: ethyl(3- {[(2- fluorophenyl)acetyl]amino}- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1ccc(n1)NC(=O)Cc1ccccc1F

STK784529
Synonyms: ethyl(3- {[(4- iodo- 1H- pyrazol- 1- yl)acetyl]amino}- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1ccc(n1)NC(=O)Cn1ncc(c1)I

STK687968
Synonyms: 5- (2- methoxyphenyl)- 3- (methylsulfonyl)- 1H- 1,2,4- triazole
Smiles: COc1ccccc1c1[nH]nc(n1)S(=O)(=O)C

STK687969
Synonyms: 2- {[5- (2- methoxyphenyl)- 3- (methylsulfonyl)- 1H- 1,2,4- triazol- 1- yl]methyl}pyridine
Smiles: COc1ccccc1c1nc(nn1Cc1ccccn1)S(=O)(=O)C

STK784530
Synonyms: N,N- diethyl- 2- [5- (2- methoxyphenyl)- 3- (methylsulfonyl)- 1H- 1,2,4- triazol- 1- yl]acetamide
Smiles: CCN(C(=O)Cn1nc(nc1c1ccccc1OC)S(=O)(=O)C)CC

STK687974
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 3- phenyl- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: O=C1CC(c2ccc3c(c2)OCO3)c2c(O1)[nH]nc2c1ccccc1

STK784538
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 3- (4- methoxyphenyl)- 4,5- dihydropyrano[2,3- c]pyrazol- 6(1H)- one
Smiles: COc1ccc(cc1)c1n[nH]c2c1C(CC(=O)O2)c1ccc2c(c1)OCO2

STK784540
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 6- methyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidine- 5- sulfonamide
Smiles: Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)NC1CCS(=O)(=O)C1

STK784542
Synonyms: 1- [4- (3- methoxyphenyl)- 2,5- dioxo- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl]- 4,6- dimethyl- 2- oxo- 1,2- dihydropyridine- 3- carbonitrile
Smiles: COc1cccc(c1)C1CC(=O)N(C2=C1C(=O)CCC2)n1c(C)cc(c(c1=O)C#N)C

STK784543
Synonyms: 1- [4- (1,3- benzodioxol- 5- yl)- 2,5- dioxo- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl]- 4,6- dimethyl- 2- oxo- 1,2- dihydropyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(n(c1=O)N1C(=O)CC(C2=C1CCCC2=O)c1ccc2c(c1)OCO2)C

STK784546
Synonyms: 7- (2- chlorobenzyl)- 5H- isoindolo[1,2- b][1,3,4]benzotriazepin- 8(7H)- one
Smiles: Clc1ccccc1Cn1c(=O)c2ccccc2nc2n1Cc1c2cccc1

STK687979
Synonyms: diethyl{[5- amino- 3- (trifluoromethyl)- 1H- 1,2,4- triazol- 1- yl](phenyl)methyl}propanedioate
Smiles: CCOC(=O)C(C(n1nc(nc1N)C(F)(F)F)c1ccccc1)C(=O)OCC

STK784547
Synonyms: 6- methyl- 2,4- dioxo- N- {3- [2- (pyridin- 2- yl)ethyl]phenyl}- 1,2,3,4- tetrahydropyrimidine- 5- sulfonamide
Smiles: Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)Nc1cccc(c1)CCc1ccccn1

STK687981
Synonyms: 4- {5- [(3,4- dichlorophenoxy)methyl]- 1,2,4- oxadiazol- 3- yl}pyridine
Smiles: Clc1ccc(cc1Cl)OCc1onc(n1)c1ccncc1

STK687982
Synonyms: 2- [(3- chlorophenyl)amino]- 5,7- dihydroxythieno[3,2- b]pyridine- 3- carbonitrile
Smiles: N#Cc1c(Nc2cccc(c2)Cl)sc2c1nc(O)cc2O

STK784549
Synonyms: 2- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- [1- (propan- 2- yl)- 1H- pyrazol- 4- yl]acetamide
Smiles: O=C(Cn1nc(c(c1C)Cl)C)Nc1cnn(c1)C(C)C

STK784550
Synonyms: 4- (morpholin- 4- ylmethyl)- 2,6- dinitroaniline
Smiles: Nc1c(cc(cc1[N+](=O)[O-])CN1CCOCC1)[N+](=O)[O-]

STK687986
Synonyms: ethyl(3- {[(3- chloro- 1- benzothiophen- 2- yl)carbonyl]amino}- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1ccc(n1)NC(=O)c1sc2c(c1Cl)cccc2

STK784553
Synonyms: ethyl(3- {[(5- bromofuran- 2- yl)carbonyl]amino}- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1ccc(n1)NC(=O)c1ccc(o1)Br

STK784554
Synonyms: ethyl(3- {[(4- nitro- 1H- pyrazol- 1- yl)acetyl]amino}- 1H- pyrazol- 1- yl)acetate
Smiles: [O-][N+](=O)c1cn(nc1)CC(=O)Nc1ccn(n1)CC(=O)OCC

STK784556
Synonyms: methyl1- methyl- 3- {[2- (tricyclo[3.3.1.1~3,7~]dec- 1- yloxy)ethyl]carbamoyl}- 1H- pyrazole- 5- carboxylate
Smiles: COC(=O)c1cc(nn1C)C(=O)NCCOC12CC3CC(C2)CC(C1)C3

STK687987
Synonyms: 3,6- diamino- 5- cyano- N- [2- (1H- indol- 3- yl)ethyl]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)NCCc1c[nH]c2c1cccc2

STK687989
Synonyms: methyl[2- (2,4- dichlorophenyl)- 5,5- dimethyl- 4,6- dioxotetrahydro- 2H- pyran- 3- yl]acetate
Smiles: COC(=O)CC1C(OC(=O)C(C1=O)(C)C)c1ccc(cc1Cl)Cl

STK784560
Synonyms: methyl[2- (4- fluorophenyl)- 5,5- dimethyl- 4,6- dioxotetrahydro- 2H- pyran- 3- yl]acetate
Smiles: COC(=O)CC1C(OC(=O)C(C1=O)(C)C)c1ccc(cc1)F

STK687990
Synonyms: (5- {[5- (4- chlorophenyl)- 2H- tetrazol- 2- yl]methyl}- 1H- tetrazol- 1- yl)aceticacid
Smiles: OC(=O)Cn1nnnc1Cn1nnc(n1)c1ccc(cc1)Cl

STK784563
Synonyms: 3- benzyl- 4- hydroxy- 4,5- dimethyl- 5- (pyridin- 3- yl)- 1,3- oxazolidin- 2- one
Smiles: O=C1OC(C(N1Cc1ccccc1)(C)O)(C)c1cccnc1

STK784565
Synonyms: 1,10b- dimethyl- 1- (pyridin- 3- yl)- 1,5,6,10b- tetrahydro[1,3]oxazolo[4,3- a]isoquinolin- 3- one
Smiles: O=C1OC(C2(N1CCc1c2cccc1)C)(C)c1cccnc1

STK687992
Synonyms: N- benzyl- 2,5- dimethoxy- 4- (1H- tetrazol- 1- yl)benzenesulfonamide
Smiles: COc1cc(c(cc1S(=O)(=O)NCc1ccccc1)OC)n1cnnn1

STK784566
Synonyms: 4- [(1,3- benzodioxol- 5- yloxy)methyl]- 2- (furan- 2- yl)- 1,3- thiazole
Smiles: c1coc(c1)c1scc(n1)COc1ccc2c(c1)OCO2

STK784567
Synonyms: N- [4- (1H- pyrrol- 1- yl)- 1,2,5- oxadiazol- 3- yl]- 2- (5H- [1,2,4]triazino[5,6- b]indol- 3- ylsulfanyl)acetamide
Smiles: O=C(Nc1nonc1n1cccc1)CSc1nnc2c(n1)[nH]c1c2cccc1

STK687993
Synonyms: 4- [(4- amino- 1,2,5- oxadiazol- 3- yl)amino]- 4- oxobutanoicacid
Smiles: Nc1nonc1NC(=O)CCC(=O)O

STK784568
Synonyms: 5- [3- (2- methylpropyl)- 1- phenyl- 1H- pyrazol- 4- yl]- 1,3,4- oxadiazol- 2- amine
Smiles: CC(Cc1nn(cc1c1nnc(o1)N)c1ccccc1)C

STK784569
Synonyms: 1- [2- (4- methoxyphenyl)- 2- methyl- 5- (pyridin- 4- yl)- 1,3,4- oxadiazol- 3(2H)- yl]ethanone
Smiles: COc1ccc(cc1)C1(C)OC(=NN1C(=O)C)c1ccncc1

STK784570
Synonyms: N- (4- chlorophenyl)- 3- (4- hydroxy- 4- methyl- 2- oxo- 1- oxa- 3- azaspiro[4.5]dec- 3- yl)propanamide
Smiles: O=C(Nc1ccc(cc1)Cl)CCN1C(=O)OC2(C1(C)O)CCCCC2

STK784571
Synonyms: 3- (4- hydroxy- 4,5,5- trimethyl- 2- oxo- 1,3- oxazolidin- 3- yl)- N- (3- methoxyphenyl)propanamide
Smiles: COc1cccc(c1)NC(=O)CCN1C(=O)OC(C1(C)O)(C)C

STK784572
Synonyms: 3- (5- ethyl- 4- hydroxy- 4,5- dimethyl- 2- oxo- 1,3- oxazolidin- 3- yl)- N- (3- methoxyphenyl)propanamide
Smiles: CCC1(C)OC(=O)N(C1(C)O)CCC(=O)Nc1cccc(c1)OC

STK784573
Synonyms: 3- (4- hydroxy- 4- methyl- 2- oxo- 1- oxa- 3- azaspiro[4.5]dec- 3- yl)- N- (3- methoxyphenyl)propanamide
Smiles: COc1cccc(c1)NC(=O)CCN1C(=O)OC2(C1(C)O)CCCCC2

STK687995
Synonyms: 3- (furan- 2- ylmethyl)- 2- methyl- 4- oxo- 3,4,5,6- tetrahydro- 2H- 2,6- methano- 1,3- benzoxazocine- 5- carboxylicacid
Smiles: OC(=O)C1C2CC(N(C1=O)Cc1ccco1)(C)Oc1c2cccc1

STK687997
Synonyms: 1- {3- [2- (pyridin- 3- yl)piperidin- 1- yl]prop- 1- yn- 1- yl}cyclopentanol
Smiles: OC1(CCCC1)C#CCN1CCCCC1c1cccnc1

STK784576
Synonyms: 8,8,9a- trimethyl- 6- thioxohexahydro- 2H- pyrimido[6,1- c][1,2,4]triazin- 3(4H)- one
Smiles: O=C1NNC2(N(C1)C(=S)NC(C2)(C)C)C

STK784577
Synonyms: 2- [1- (4- chlorobenzyl)- 1H- indol- 3- yl]- N- (2- chlorophenyl)- 2- oxoacetamide
Smiles: Clc1ccc(cc1)Cn1cc(c2c1cccc2)C(=O)C(=O)Nc1ccccc1Cl

STK784578
Synonyms: 1- [(1,3- dimethyl- 1H- pyrazol- 4- yl)sulfonyl]- N- (4- fluorobenzyl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)S(=O)(=O)c1cn(nc1C)C)NCc1ccc(cc1)F

STK687998
Synonyms: furan- 2- yl(3- methyl- 5- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl)acetonitrile
Smiles: N#CC(N1N=C(CC1c1ccccc1)C)c1ccco1

STK784579
Synonyms: (5- bromo- 2- hydroxyphenyl)(3- methyl- 5- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl)acetonitrile
Smiles: N#CC(N1N=C(CC1c1ccccc1)C)c1cc(Br)ccc1O

STK784580
Synonyms: 2- [1- (4- chlorobenzyl)- 1H- indol- 3- yl]- N- (2- ethoxyphenyl)- 2- oxoacetamide
Smiles: CCOc1ccccc1NC(=O)C(=O)c1cn(c2c1cccc2)Cc1ccc(cc1)Cl

STK784581
Synonyms: 1- [(1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)sulfonyl]- N- (2- fluoro- 5- methylphenyl)piperidine- 4- carboxamide
Smiles: CCn1nc(c(c1C)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cc(C)ccc1F)C

STK784582
Synonyms: 1- [(1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)sulfonyl]- N- (3- fluorophenyl)piperidine- 4- carboxamide
Smiles: CCn1nc(c(c1C)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc(c1)F)C

STK784583
Synonyms: N- (3,4- dimethoxyphenyl)- 1- [(1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)sulfonyl]piperidine- 4- carboxamide
Smiles: COc1ccc(cc1OC)NC(=O)C1CCN(CC1)S(=O)(=O)c1c(C)nn(c1C)CC

STK784584
Synonyms: 4- hydroxy- 3,4,5- trimethyl- 5- (pyridin- 3- yl)- 1,3- oxazolidin- 2- one
Smiles: O=C1OC(C(N1C)(C)O)(C)c1cccnc1

STK784585
Synonyms: 3- [2- (3,4- dimethoxyphenyl)ethyl]- 4- hydroxy- 4,5- dimethyl- 5- (pyridin- 3- yl)- 1,3- oxazolidin- 2- one
Smiles: COc1cc(CCN2C(=O)OC(C2(C)O)(C)c2cccnc2)ccc1OC

STK784587
Synonyms: 2,4- dichloro- 6- [(1H- indazol- 7- ylamino)methyl]phenol
Smiles: Clc1cc(CNc2cccc3c2[nH]nc3)c(c(c1)Cl)O

STK784588
Synonyms: 4,6- dimethyl- 2- oxo- 1- [(3- oxocyclohex- 1- en- 1- yl)amino]- 1,2- dihydropyridine- 3- carbonitrile
Smiles: Cc1cc(C)c(c(=O)n1NC1=CC(=O)CCC1)C#N

STK784589
Synonyms: 4- (2,4,5- trimethoxyphenyl)- 3,4- dihydro- 2H- pyrido[3,2- e][1,3]thiazolo[3,2- a]pyrimidine- 2,5(1H)- dione
Smiles: COc1cc(OC)c(cc1C1CC(=O)Nc2c1c(=O)nc1n2ccs1)OC

STK784594
Synonyms: 4- (4- hydroxy- 3,5- dimethoxyphenyl)- 3,4- dihydro- 2H- pyrido[3,2- e][1,3]thiazolo[3,2- a]pyrimidine- 2,5(1H)- dione
Smiles: COc1cc(cc(c1O)OC)C1CC(=O)Nc2c1c(=O)nc1n2ccs1

STK784595
Synonyms: 4- [4- (benzyloxy)phenyl]- 3,4- dihydro- 2H- pyrido[3,2- e][1,3]thiazolo[3,2- a]pyrimidine- 2,5(1H)- dione
Smiles: O=C1CC(c2ccc(cc2)OCc2ccccc2)c2c(N1)n1ccsc1nc2=O

STK688004
Synonyms: N- (3- oxido- 2,3- dihydro- 1,3- benzoxaphosphol- 3- yl)pyridin- 2- amine
Smiles: O=P1(COc2c1cccc2)Nc1ccccn1

STK688005
Synonyms: 4- (6,7- difluoroquinoxalin- 2- yl)benzene- 1,2,3- triol
Smiles: Oc1ccc(c(c1O)O)c1cnc2c(n1)cc(c(c2)F)F

STK688008
Synonyms: 3- (carboxymethyl)- 2- methyl- 1H- indole- 6- carboxylicacid
Smiles: OC(=O)Cc1c(C)[nH]c2c1ccc(c2)C(=O)O

STK688009
Synonyms: 1- (1H- benzimidazol- 2- ylmethyl)- 2- (trifluoromethyl)- 1H- benzimidazole
Smiles: FC(c1nc2c(n1Cc1nc3c([nH]1)cccc3)cccc2)(F)F

STK784601
Synonyms: 2- (2- {[2- (trifluoromethyl)- 1H- benzimidazol- 1- yl]methyl}- 1H- benzimidazol- 1- yl)acetamide
Smiles: NC(=O)Cn1c(nc2c1cccc2)Cn1c2ccccc2nc1C(F)(F)F

STK688010
Synonyms: 9- ethyl- 3- (methylsulfonyl)- 9H- [1,2,4]triazolo[4,3- a]benzimidazole
Smiles: CCn1c2nnc(n2c2c1cccc2)S(=O)(=O)C

STK688011
Synonyms: 2- [2- (piperidin- 1- ylmethyl)- 1H- benzimidazol- 1- yl]ethanol
Smiles: OCCn1c(CN2CCCCC2)nc2c1cccc2

STK784602
Synonyms: 6- (dimethylamino)- 6,6a- dihydroisoindolo[2,1- a]quinazoline- 5,11- dione
Smiles: O=C1c2ccccc2C2N1c1ccccc1C(=O)N2N(C)C

STK688012
Synonyms: N- (2- {[(4- fluorophenoxy)acetyl]amino}ethyl)- 3- (thiophen- 2- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(COc1ccc(cc1)F)NCCNC(=O)c1onc(n1)c1cccs1

STK688016
Synonyms: 9- (methoxymethyl)- 7- methyl- 2,4- diphenyl- 4H- pyrido[3',2':4,5]thieno[3,2- d][1,3]oxazine
Smiles: COCc1cc(C)nc2c1c1N=C(OC(c1s2)c1ccccc1)c1ccccc1

STK688019
Synonyms: 1- benzyl- 2- cyclohexyl- 5- (methoxymethyl)- 7- methyl- 2,3- dihydropyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2Cc1ccccc1)C1CCCCC1

STK688020
Synonyms: 2- [(4- {[(1H- benzimidazol- 2- ylsulfanyl)acetyl]amino}- 1,2,5- oxadiazol- 3- yl)carbamoyl]benzoicacid
Smiles: O=C(Nc1nonc1NC(=O)c1ccccc1C(=O)O)CSc1nc2c([nH]1)cccc2

STK784610
Synonyms: 3- ethyl- 4- hydroxy- 4,5- dimethyl- 5- (pyridin- 3- yl)- 1,3- oxazolidin- 2- one
Smiles: CCN1C(=O)OC(C1(C)O)(C)c1cccnc1

STK688021
Synonyms: 3- benzyl- 2- methyl- 4- oxo- 3,4,5,6- tetrahydro- 2H- 2,6- methano- 1,3- benzoxazocine- 5- carboxylicacid
Smiles: OC(=O)C1C2CC(N(C1=O)Cc1ccccc1)(C)Oc1c2cccc1

STK688022
Synonyms: N- benzyl- N- [3- cyano- 4- (methoxymethyl)- 6- methylpyridin- 2- yl]formamide
Smiles: COCc1cc(C)nc(c1C#N)N(Cc1ccccc1)C=O

STK688023
Synonyms: {2- oxo- 2- [(2- oxo- 2,3- dihydro- 1H- benzimidazol- 5- yl)amino]ethoxy}aceticacid
Smiles: O=C(Nc1ccc2c(c1)[nH]c(=O)[nH]2)COCC(=O)O

STK688024
Synonyms: 4- [(3,4- dimethoxyphenyl)sulfonyl]- 3- methyl- 2- phenylmorpholine
Smiles: COc1cc(ccc1OC)S(=O)(=O)N1CCOC(C1C)c1ccccc1

STK688025
Synonyms: ethyl5- methoxy- 2- [(pyridin- 2- ylsulfanyl)methyl]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(CSc2ccccn2)oc2c1cc(OC)cc2

STK784612
Synonyms: 5- {4- [(3- fluorobenzyl)oxy]- 3- methoxyphenyl}- 1,3- dimethyl- 5,8- dihydropyrido[2,3- d]pyrimidine- 2,4,7(1H,3H,6H)- trione
Smiles: COc1cc(ccc1OCc1cccc(c1)F)C1CC(=O)Nc2c1c(=O)n(c(=O)n2C)C

STK784616
Synonyms: 5- (6- amino- 1,3- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)- 6- (4- chlorophenyl)- 1,3- dimethyl- 1H- pyrrolo[2,3- d]pyrimidine- 2,4(3H,7H)- dione
Smiles: Clc1ccc(cc1)c1[nH]c2c(c1c1c(N)n(C)c(=O)n(c1=O)C)c(=O)n(c(=O)n2C)C

STK688026
Synonyms: ethyl5- nitro- 2- oxo- 1,1',2,2',5',6',7',7a'- octahydrospiro[indole- 3,3'- pyrrolizine]- 1'- carboxylate
Smiles: CCOC(=O)C1CC2(N3C1CCC3)C(=O)Nc1c2cc(cc1)[N+](=O)[O-]

STK688027
Synonyms: ethyl5- bromo- 2- oxo- 1,1',2,2',5',6',7',7a'- octahydrospiro[indole- 3,3'- pyrrolizine]- 1'- carboxylate
Smiles: CCOC(=O)C1CC2(N3C1CCC3)C(=O)Nc1c2cc(Br)cc1

STK688029
Synonyms: 3- (4- methylphenyl)- 4- (pyridin- 3- yl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(1H)- one
Smiles: Cc1ccc(cc1)c1n[nH]c2c1C(NC2=O)c1cccnc1

STK784617
Synonyms: 3- (4- methoxyphenyl)- 4- (pyridin- 3- yl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(1H)- one
Smiles: COc1ccc(cc1)c1n[nH]c2c1C(NC2=O)c1cccnc1

STK784618
Synonyms: 3- (3- methoxyphenyl)- 4- (pyridin- 3- yl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(1H)- one
Smiles: COc1cccc(c1)c1n[nH]c2c1C(NC2=O)c1cccnc1

STK784619
Synonyms: 4- (2- fluorophenyl)- 3- (furan- 2- yl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(1H)- one
Smiles: Fc1ccccc1C1NC(=O)c2c1c(n[nH]2)c1ccco1

STK784620
Synonyms: 4- (pyridin- 3- yl)- 3- (thiophen- 2- yl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(1H)- one
Smiles: O=C1NC(c2c1[nH]nc2c1cccs1)c1cccnc1

STK688030
Synonyms: 3- [5- (4- chlorophenyl)- 8- oxo- 6- (pyridin- 3- yl)- 2,3,6,8- tetrahydropyrrolo[3,4- e][1,4]diazepin- 7(1H)- yl]benzoicacid
Smiles: Clc1ccc(cc1)C1=NCCNC2=C1C(c1cccnc1)N(C2=O)c1cccc(c1)C(=O)O

STK784621
Synonyms: methyl2- benzyl- 7- [(phenylacetyl)amino]- 1,3- benzoxazole- 5- carboxylate
Smiles: COC(=O)c1cc(NC(=O)Cc2ccccc2)c2c(c1)nc(o2)Cc1ccccc1

STK784622
Synonyms: methyl2- benzyl- 7- {[(3,4- dimethoxyphenyl)carbonyl]amino}- 1,3- benzoxazole- 5- carboxylate
Smiles: COC(=O)c1cc(NC(=O)c2ccc(c(c2)OC)OC)c2c(c1)nc(o2)Cc1ccccc1

STK784623
Synonyms: methyl2- benzyl- 7- [(furan- 2- ylcarbonyl)amino]- 1,3- benzoxazole- 5- carboxylate
Smiles: COC(=O)c1cc(NC(=O)c2ccco2)c2c(c1)nc(o2)Cc1ccccc1

STK784625
Synonyms: methyl2- benzyl- 7- {[(2,5- dimethylthiophen- 3- yl)sulfonyl]amino}- 1,3- benzoxazole- 5- carboxylate
Smiles: COC(=O)c1cc(NS(=O)(=O)c2cc(sc2C)C)c2c(c1)nc(o2)Cc1ccccc1

STK688034
Synonyms: 3- (thiophen- 2- yl)- N- {2- [(thiophen- 2- ylcarbonyl)amino]ethyl}- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1cccs1)NCCNC(=O)c1cccs1

STK784628
Synonyms: 6- methyl- N- (pyridin- 3- ylmethyl)[1,2,4]triazolo[1,5- b]pyridazin- 8- amine
Smiles: Cc1cc(NCc2cccnc2)c2n(n1)ncn2

STK688036
Synonyms: 6- methyl- 8- [4- (pyridin- 2- yl)piperazin- 1- yl][1,2,4]triazolo[4,3- b]pyridazine
Smiles: Cc1nn2cnnc2c(c1)N1CCN(CC1)c1ccccn1

STK688037
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 6- methyl[1,2,4]triazolo[4,3- b]pyridazin- 8- amine
Smiles: Cc1cc(NCc2ccc3c(c2)OCO3)c2n(n1)cnn2

STK688038
Synonyms: N- [3- bromo- 5- methoxy- 4- (propan- 2- yloxy)benzyl]- 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 4H- 1,2,4- triazol- 4- amine
Smiles: COc1cc(CNn2cnnc2n2nc(cc2C)C)cc(c1OC(C)C)Br

STK688039
Synonyms: 1- phenyl- 7- (2- phenylethyl)- 1,3,7- triazaspiro[4.5]decan- 4- one
Smiles: O=C1NCN(C21CCCN(C2)CCc1ccccc1)c1ccccc1

STK688040
Synonyms: N- (3- methoxyphenyl)- 5- (phenylcarbonyl)- 2,3- dihydro- 1,4- benzodioxine- 6- carboxamide
Smiles: COc1cccc(c1)NC(=O)c1ccc2c(c1C(=O)c1ccccc1)OCCO2

STK784630
Synonyms: 3- (furan- 2- yl)- N- (furan- 2- ylmethyl)- 4- phenylbutan- 1- amine
Smiles: C(CC(c1ccco1)Cc1ccccc1)NCc1ccco1

STK784631
Synonyms: N- (furan- 2- ylmethyl)- 2- oxo- 1- oxaspiro[4.4]nonane- 4- carboxamide
Smiles: O=C1CC(C2(O1)CCCC2)C(=O)NCc1ccco1

STK688041
Synonyms: N- ethyl- 2- oxo- 1- oxaspiro[4.4]nonane- 4- carboxamide
Smiles: CCNC(=O)C1CC(=O)OC21CCCC2

STK784632
Synonyms: 5,7- diphenyl- 2- (pyridin- 2- yl)- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: O=C1C2(CN3CC1(CN(C2)C3c1ccccn1)c1ccccc1)c1ccccc1

STK784635
Synonyms: methyl4- (3- {[(5- bromofuran- 2- yl)carbonyl]amino}- 5- methyl- 1H- pyrazol- 1- yl)butanoate
Smiles: COC(=O)CCCn1nc(cc1C)NC(=O)c1ccc(o1)Br

STK688043
Synonyms: 3- (2,2- dimethyltetrahydro- 2H- pyran- 4- yl)- N- (4- methoxybenzyl)- 4- methylpentan- 1- amine
Smiles: COc1ccc(cc1)CNCCC(C1CCOC(C1)(C)C)C(C)C

STK688045
Synonyms: N- (1,3- benzodioxol- 4- ylmethyl)- 2- [2,2- dimethyl- 4- (propan- 2- yl)tetrahydro- 2H- pyran- 4- yl]ethanamine
Smiles: CC(C1(CCNCc2cccc3c2OCO3)CCOC(C1)(C)C)C

STK784637
Synonyms: 2,4- dichloro- N- (2- cyano- 3,3- dimethyl- 3,4- dihydronaphthalen- 1- yl)benzamide
Smiles: N#CC1=C(NC(=O)c2ccc(cc2Cl)Cl)c2ccccc2CC1(C)C

STK784639
Synonyms: 1- [(3- ethoxy- 4- fluorophenyl)sulfonyl]- 2- methyl- 4,5- dihydro- 1H- imidazole
Smiles: CCOc1cc(ccc1F)S(=O)(=O)N1CCN=C1C

STK784640
Synonyms: 1- [(4- chloro- 2,5- dimethoxyphenyl)sulfonyl]- 4- methyl- 2- phenyl- 1H- imidazole
Smiles: COc1cc(Cl)c(cc1S(=O)(=O)n1cc(nc1c1ccccc1)C)OC

STK688049
Synonyms: 1- (2,3- dihydro- 1H- inden- 5- yloxy)- 3- [4- (morpholin- 4- ylsulfonyl)piperazin- 1- yl]propan- 2- ol
Smiles: OC(CN1CCN(CC1)S(=O)(=O)N1CCOCC1)COc1ccc2c(c1)CCC2

STK784641
Synonyms: 1- (2,3- dihydro- 1H- inden- 5- yloxy)- 3- [4- (piperidin- 1- ylsulfonyl)piperazin- 1- yl]propan- 2- ol
Smiles: OC(CN1CCN(CC1)S(=O)(=O)N1CCCCC1)COc1ccc2c(c1)CCC2

STK784642
Synonyms: N- (4- {2- hydroxy- 3- [4- (morpholin- 4- ylsulfonyl)piperazin- 1- yl]propoxy}phenyl)acetamide
Smiles: OC(CN1CCN(CC1)S(=O)(=O)N1CCOCC1)COc1ccc(cc1)NC(=O)C

STK688050
Synonyms: 4- fluoro- N- {1- [4- (1H- imidazol- 1- yl)phenyl]ethyl}- 3- methylbenzenesulfonamide
Smiles: CC(c1ccc(cc1)n1cncc1)NS(=O)(=O)c1ccc(c(c1)C)F

STK688051
Synonyms: 5- chloro- N- {1- [4- (1H- imidazol- 1- yl)phenyl]ethyl}- 2- methoxy- 4- methylbenzenesulfonamide
Smiles: COc1cc(C)c(cc1S(=O)(=O)NC(c1ccc(cc1)n1cncc1)C)Cl

STK784646
Synonyms: 6- methoxy- 3- [(2- methyl- 2,3- dihydro- 1H- indol- 1- yl)carbonyl]- 2H- chromen- 2- one
Smiles: COc1ccc2c(c1)cc(c(=O)o2)C(=O)N1C(C)Cc2c1cccc2

STK784647
Synonyms: 3- ethyl- N- (1H- indazol- 7- yl)- 4- methoxybenzenesulfonamide
Smiles: CCc1cc(ccc1OC)S(=O)(=O)Nc1cccc2c1[nH]nc2

STK784648
Synonyms: N- (3- acetylphenyl)- 3- (1H- 1,2,4- triazol- 1- yl)propanamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)CCn1cncn1

STK784649
Synonyms: 3- (3,5- dimethyl- 1H- 1,2,4- triazol- 1- yl)- N- (furan- 2- ylmethyl)propanamide
Smiles: O=C(CCn1nc(nc1C)C)NCc1ccco1

STK784651
Synonyms: 1- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- ylmethyl)- 3'- (4- ethoxyphenyl)- 4'H- spiro[indole- 3,2'- [1,3]thiazolidine]- 2,4'(1H)- dione
Smiles: CCOc1ccc(cc1)N1C(=O)CSC21c1ccccc1N(C2=O)CN1CCC2(CC1)OCCO2

STK784654
Synonyms: 11- {4- [(2- chlorobenzyl)oxy]- 3- ethoxyphenyl}- 3,3- dimethyl- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: CCOc1cc(ccc1OCc1ccccc1Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)(C)C

STK784655
Synonyms: 2- {3- ethoxy- 4- [(4- fluorobenzyl)oxy]phenyl}- 1,3- bis(4- methylphenyl)imidazolidine
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)F)C1N(CCN1c1ccc(cc1)C)c1ccc(cc1)C

STK688056
Synonyms: 2- [5- (2- fluorophenyl)- 3- (methylsulfonyl)- 1H- 1,2,4- triazol- 1- yl]acetamide
Smiles: NC(=O)Cn1nc(nc1c1ccccc1F)S(=O)(=O)C

STK784659
Synonyms: 2- methoxyethyl5- hydroxy- 2- methyl- 1- {3- [(4- nitrophenyl)amino]propyl}- 1H- indole- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)n(c2c1cc(O)cc2)CCCNc1ccc(cc1)[N+](=O)[O-]

STK784660
Synonyms: 2- methoxyethyl1- {2- [(2- chlorobenzyl)oxy]ethyl}- 5- hydroxy- 2- methyl- 1H- indole- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)n(c2c1cc(O)cc2)CCOCc1ccccc1Cl

STK784661
Synonyms: 3- (4- chlorobenzyl)- 4,5- dihydroxy- 4,5- dimethyl- 1,3- oxazolidin- 2- one
Smiles: O=C1OC(C(N1Cc1ccc(cc1)Cl)(C)O)(C)O

STK784662
Synonyms: methyl5- amino- 1- (4- chloro- 2- methylphenyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: COC(=O)c1nnn(c1N)c1ccc(cc1C)Cl

STK688057
Synonyms: (1- methyl- 1H- imidazol- 2- yl)(pyridin- 2- yl)methanone
Smiles: Cn1ccnc1C(=O)c1ccccn1

STK688058
Synonyms: (1- methyl- 1H- imidazol- 2- yl)[3- (trifluoromethyl)phenyl]methanone
Smiles: Cn1ccnc1C(=O)c1cccc(c1)C(F)(F)F

STK688059
Synonyms: N- {1- [4- (1H- imidazol- 1- yl)phenyl]ethyl}- 4- methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)NC(c1ccc(cc1)n1cncc1)C

STK688060
Synonyms: 1- [4- (3- chloro- 4- methylphenyl)piperazin- 1- yl]- 3- [3- (1,3,4- oxadiazol- 2- yl)phenoxy]propan- 2- ol
Smiles: OC(CN1CCN(CC1)c1ccc(c(c1)Cl)C)COc1cccc(c1)c1nnco1

STK688061
Synonyms: (4a,6a- dimethyltetrahydro- 2H- 1,4- dioxa- 6b- azacyclopenta[cd]pentalen- 2a(3H)- yl)methyl(phenylsulfonyl)carbamate
Smiles: O=C(NS(=O)(=O)c1ccccc1)OCC12COC3(N2C(OC1)(C)CC3)C

STK784663
Synonyms: 2- methoxyethyl5- hydroxy- 2- methyl- 1- {2- [(4- nitrophenyl)amino]ethyl}- 1H- indole- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)n(c2c1cc(O)cc2)CCNc1ccc(cc1)[N+](=O)[O-]

STK784665
Synonyms: 4- hydroxy- 4,5- dimethyl- 5- (pyridin- 3- yl)- 1,3- oxazolidin- 2- one
Smiles: O=C1NC(C(O1)(C)c1cccnc1)(C)O

STK688064
Synonyms: 3,3,4- tricyano- 8a- hydroxy- 2- methyloctahydro- 2H- chromene- 4- carboxamide
Smiles: N#CC1(C(=O)N)C2CCCCC2(O)OC(C1(C#N)C#N)C

STK688065
Synonyms: ethyl5- cyano- 2- methyl- 4- [4- (methylsulfanyl)phenyl]- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)C(C1c1ccc(cc1)SC)C#N

STK688069
Synonyms: 2- [5- (2- fluorophenyl)- 3- (methylsulfonyl)- 1H- 1,2,4- triazol- 1- yl]- 1- (morpholin- 4- yl)ethanone
Smiles: O=C(N1CCOCC1)Cn1nc(nc1c1ccccc1F)S(=O)(=O)C

STK688079
Synonyms: 7- {3- [4- (4- methylphenoxy)phenyl]- 1,2,4- oxadiazol- 5- yl}hexahydro- 2H- 3,5- methanocyclopenta[b]furan- 2- one
Smiles: O=C1OC2C3C1C(C(C2)C3)c1onc(n1)c1ccc(cc1)Oc1ccc(cc1)C

STK784671
Synonyms: 6- (2,4- dichlorophenyl)- 3- (pyridin- 4- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Clc1ccc(c(c1)Cl)c1nn2c(s1)nnc2c1ccncc1

STK688089
Synonyms: (6S,6aR,13R,13aS)- N- (1,3- benzodioxol- 5- yl)- 3,4,6,7,8,9,10,12,13,13a- decahydro- 2H- 6,13- methanodipyrido[1,2- a:3',2'- e]azocine- 1(6aH)- carbothioamide
Smiles: S=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)Nc1ccc2c(c1)OCO2

STK784673
Synonyms: 4- (bicyclo[2.2.1]hept- 5- en- 2- yl)- 5- (3- phenyl- 1H- pyrazol- 5- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Sc1nnc(n1C1CC2CC1C=C2)c1[nH]nc(c1)c1ccccc1

STK784674
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5- (furan- 2- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Sc1nnc(n1c1ccc2c(c1)OCCO2)c1ccco1

STK784676
Synonyms: 2- ([1,2,4]triazolo[1,5- c]quinazolin- 2- ylmethyl)phthalazin- 1(2H)- one
Smiles: O=c1n(ncc2c1cccc2)Cc1nc2n(n1)cnc1c2cccc1

STK784679
Synonyms: 2- {2- [4- (3- chloro- 4- fluorophenyl)- 5- sulfanyl- 4H- 1,2,4- triazol- 3- yl]ethyl}phthalazin- 1(2H)- one
Smiles: Fc1ccc(cc1Cl)n1c(nnc1S)CCn1ncc2c(c1=O)cccc2

STK784682
Synonyms: 3- (5- bromofuran- 2- yl)- 5- {[5- methyl- 3- (trifluoromethyl)- 1H- pyrazol- 1- yl]methyl}- 1,2,4- oxadiazole
Smiles: Brc1ccc(o1)c1noc(n1)Cn1nc(cc1C)C(F)(F)F

STK784685
Synonyms: 5- (3- methoxyphenyl)- N- (3- methylpent- 1- yn- 3- yl)- 1,2- oxazole- 3- carboxamide
Smiles: CCC(NC(=O)c1noc(c1)c1cccc(c1)OC)(C#C)C

STK688100
Synonyms: 3- (4- chlorophenyl)- N- (3- methylpent- 1- yn- 3- yl)- 4,5- dihydro- 1,2- oxazole- 5- carboxamide
Smiles: CCC(NC(=O)C1ON=C(C1)c1ccc(cc1)Cl)(C#C)C

STK688102
Synonyms: 2,3- dimethyl- 1H- pyrrolo[2,3- b]pyridin- 1- amine
Smiles: Cc1n(N)c2c(c1C)cccn2

STK688103
Synonyms: N- (2- cyclohexyl- 2- phenylethyl)- 6- methyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidine- 5- sulfonamide
Smiles: Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)NCC(c1ccccc1)C1CCCCC1

STK688104
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 6- methyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidine- 5- sulfonamide
Smiles: Clc1ccc2c(c1)c(CCNS(=O)(=O)c1c(C)[nH]c(=O)[nH]c1=O)c[nH]2

STK784687
Synonyms: N- [3- (2- fluorophenyl)- 2- phenylpropyl]- 6- methyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidine- 5- sulfonamide
Smiles: Fc1ccccc1CC(c1ccccc1)CNS(=O)(=O)c1c(C)[nH]c(=O)[nH]c1=O

STK784688
Synonyms: ethyl5- methoxy- 1,2- dimethyl- 4- {[(6- methyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)sulfonyl]amino}- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c2c(NS(=O)(=O)c3c(C)[nH]c(=O)[nH]c3=O)c(OC)ccc2n(c1C)C

STK688105
Synonyms: methyl3- {[(6- methyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)sulfonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NS(=O)(=O)c1c(C)[nH]c(=O)[nH]c1=O)cccc2

STK784689
Synonyms: N- [2- ({[3- (thiophen- 2- yl)- 1,2,4- oxadiazol- 5- yl]carbonyl}amino)ethyl]pyrazine- 2- carboxamide
Smiles: O=C(c1onc(n1)c1cccs1)NCCNC(=O)c1cnccn1

STK784690
Synonyms: 3- (4- fluorophenyl)- N- (2- {[(4- fluorophenyl)acetyl]amino}ethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(Cc1ccc(cc1)F)NCCNC(=O)c1onc(n1)c1ccc(cc1)F

STK784691
Synonyms: N- [2- ({[3- (4- fluorophenyl)- 1,2,4- oxadiazol- 5- yl]carbonyl}amino)ethyl]pyrazine- 2- carboxamide
Smiles: Fc1ccc(cc1)c1noc(n1)C(=O)NCCNC(=O)c1cnccn1

STK688107
Synonyms: 2- {[2- (2- oxo- 1- oxaspiro[4.5]dec- 3- en- 4- yl)- 1,2,3,4- tetrahydroisoquinolin- 1- yl]methyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1C=C(C2(O1)CCCCC2)N1CCc2c(C1CN1C(=O)c3c(C1=O)cccc3)cccc2

STK688108
Synonyms: 1- benzyl- 2,6- diethynyl- 4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)piperazine
Smiles: C#CC1CN(CC(N1Cc1ccccc1)C#C)C12CC3CC(C2)CC(C1)C3

STK784696
Synonyms: 1,3- dimethyl- 7- [2- (4- methylphenyl)- 2- oxoethyl]- 8- (pyrrolidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)C(=O)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCC1