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

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STK576675
Synonyms: (5Z)- 5- [5- (1,3- benzodioxol- 5- yl)pyrazolidin- 3- ylidene]- 6- hydroxy- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C\2/NNC(C2)c2ccc3c(c2)OCO3)/C1=O)O

STK576677
Synonyms: 7- fluoro- 2- methyl- 4- [2- (piperidin- 1- yl)ethyl]- 4H- [1,3]thiazolo[5,4- b]indole
Smiles: Fc1ccc2c(c1)c1nc(sc1n2CCN1CCCCC1)C

STK576678
Synonyms: 3- butyl- 7- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCn1cnc2c(c1=O)[nH]c1c2ccc(c1)C

STK576684
Synonyms: tert- butyl[(1S)- 1- {5- [(4- chlorobenzyl)sulfonyl]- 1,3,4- oxadiazol- 2- yl}- 3- methylbutyl]carbamate
Smiles: CC(C[C@@H](c1nnc(o1)S(=O)(=O)Cc1ccc(cc1)Cl)NC(=O)OC(C)(C)C)C

STK576685
Synonyms: 5- ({2- [(4- fluorobenzyl)oxy]- 3- methoxybenzyl}amino)- 2- (morpholin- 4- ium- 4- yl)benzoate
Smiles: COc1cccc(c1OCc1ccc(cc1)F)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK576688
Synonyms: 7- (4- benzylpiperazin- 1- yl)- 2- ethyl- 5- methyl- 3- phenylpyrazolo[1,5- a]pyrimidine
Smiles: CCc1nn2c(c1c1ccccc1)nc(cc2N1CCN(CC1)Cc1ccccc1)C

STK848661
Synonyms: N- [2- methyl- 5- (6- methyl[1,2,4]triazolo[3,4- a]phthalazin- 3- yl)phenyl]furan- 2- carboxamide
Smiles: Cc1ccc(cc1NC(=O)c1ccco1)c1nnc2n1nc(C)c1c2cccc1

STK576695
Synonyms: 11- (2- chlorophenyl)- 10- methyl- 8- phenyl- 2- (pyridin- 3- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1cccnc1)c1ccccc1

STK576704
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[4- amino- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK848663
Synonyms: 2,8,10- trimethyl- 4- [4- (2- methylphenyl)piperazin- 1- yl]pyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidine
Smiles: Cc1cc(N2CCN(CC2)c2ccccc2C)n2c(n1)c1c(C)cc(nc1n2)C

STK576706
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 5- (2- hydroxyethyl)- 4- (4- methylphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1ccc(cc1)C)c([nH]n2)c1cc(Cl)c(cc1O)C

STK576707
Synonyms: 7- [4- (4- chlorobenzyl)piperazin- 1- yl]- 3- (4- chlorophenyl)- 5- methylpyrazolo[1,5- a]pyrimidine
Smiles: Clc1ccc(cc1)CN1CCN(CC1)c1cc(C)nc2n1ncc2c1ccc(cc1)Cl

STK848664
Synonyms: 1,9- dimethyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: NC(=O)c1cc2c(n1C)nc1n(c2=O)cccc1C

STK848665
Synonyms: 2,5- dimethyl- 3- phenyl- 6- propylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCCc1c(C)nc2n(c1O)nc(c2c1ccccc1)C

STK576715
Synonyms: 5- (5- chloro- 2- hydroxyphenyl)- N- (5- chloro- 2- methoxyphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: COc1ccc(cc1NC(=O)c1n[nH]c(c1)c1cc(Cl)ccc1O)Cl

STK576717
Synonyms: 5- (4- chlorophenyl)- 4- imino- 3- [2- (morpholin- 4- yl)ethyl]- 3,5- dihydro- 4H- chromeno[2,3- d]pyrimidin- 8- ol
Smiles: Clc1ccc(cc1)C1c2ccc(cc2Oc2c1c(=N)n(cn2)CCN1CCOCC1)O

STK848666
Synonyms: N- (2- methoxyethyl)- 2,8,10- trimethylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidin- 4- amine
Smiles: COCCNc1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK576721
Synonyms: 5- (2- hydroxyphenyl)- N- [2- (phenylcarbonyl)- 1- benzofuran- 3- yl]- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccccc1O)Nc1c(oc2c1cccc2)C(=O)c1ccccc1

STK576726
Synonyms: 4- chloro- N- [(2- hydroxyquinolin- 4- yl)methyl]- N- propylbenzamide
Smiles: CCCN(C(=O)c1ccc(cc1)Cl)Cc1cc(O)nc2c1cccc2

STK576735
Synonyms: 2,4- diamino- 9- (phenylcarbonyl)- 3- thia- 9- azaspiro[5.5]undeca- 1,4- diene- 1,5- dicarbonitrile
Smiles: N#CC1=C(N)SC(=C(C21CCN(CC2)C(=O)c1ccccc1)C#N)N

STK576736
Synonyms: 2- [(3- methoxybenzyl)amino]- 6,7- dihydro- 5H- cyclopenta[d][1,2,4]triazolo[1,5- a]pyrimidin- 8- ol
Smiles: COc1cccc(c1)CNc1nc2n(n1)c(O)c1c(n2)CCC1

STK576738
Synonyms: N- (4- sulfamoylbenzyl)- 2- [(3,4,7- trimethyl- 2- oxo- 2H- chromen- 5- yl)oxy]acetamide
Smiles: O=C(COc1cc(C)cc2c1c(C)c(c(=O)o2)C)NCc1ccc(cc1)S(=O)(=O)N

STK576739
Synonyms: [(5S)- 5- [(4- acetylphenyl)carbamoyl]- 3- (4- bromophenyl)- 4,5- dihydro- 1,2- oxazol- 5- yl]aceticacid
Smiles: OC(=O)C[C@]1(ON=C(C1)c1ccc(cc1)Br)C(=O)Nc1ccc(cc1)C(=O)C

STK576740
Synonyms: 5- tert- butyl- 7- [4- (diphenylmethyl)piperazin- 1- yl]- 3- phenylpyrazolo[1,5- a]pyrimidine
Smiles: CC(c1cc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)n2c(n1)c(cn2)c1ccccc1)(C)C

STK576741
Synonyms: 3- (3- hydroxypropyl)- 4- imino- 5- (2- methoxyphenyl)- 3,5- dihydro- 4H- chromeno[2,3- d]pyrimidin- 8- ol
Smiles: OCCCn1cnc2c(c1=N)C(c1ccccc1OC)c1c(O2)cc(cc1)O

STK576742
Synonyms: 2- ({[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}methyl)- 1H- benzimidazole
Smiles: Clc1cccc(c1)c1nnc(n1C)SCc1nc2c([nH]1)cccc2

STK848670
Synonyms: (2Z)- 7- methyl- 2- (phenylimino)- 2,6,7,8- tetrahydroquinazolin- 5(1H)- one
Smiles: CC1CC(=O)c2c(C1)[nH]/c(=N/c1ccccc1)/nc2

STK576746
Synonyms: N- (furan- 2- ylmethyl)- 4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- amine
Smiles: CC(c1nc2oc3c(c2c2c1CCC2)ncnc3NCc1ccco1)C

STK576748
Synonyms: 2- [4- (4- methoxyphenyl)- 3- methyl- 1,2- oxazol- 5- yl]- 5- [(4- nitrobenzyl)oxy]phenol
Smiles: COc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1ccc(cc1)[N+](=O)[O-]

STK576749
Synonyms: 5- [(2,4- dichlorobenzyl)oxy]- 2- [4- (3,4- dimethoxyphenyl)- 3- methyl- 1H- pyrazol- 5- yl]phenol
Smiles: COc1cc(ccc1OC)c1c(C)n[nH]c1c1ccc(cc1O)OCc1ccc(cc1Cl)Cl

STK848672
Synonyms: 2- methyl- 3- phenyl- 5- propyl- N- (pyridin- 3- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CCCc1cc(NCc2cccnc2)n2c(n1)c(c1ccccc1)c(n2)C

STK576751
Synonyms: 1- (5- benzyl- 4- hydroxy- 6- methylpyrimidin- 2- yl)- 3- [2- (trifluoromethyl)phenyl]guanidine
Smiles: N=C(Nc1ccccc1C(F)(F)F)Nc1nc(C)c(c(n1)O)Cc1ccccc1

STK848673
Synonyms: N- cyclohexyl- N- ethyl- 1- (3- methoxypropyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)N(C1CCCCC1)CC

STK576753
Synonyms: 6- hydroxy- 8- [4- (2- hydroxyethyl)piperazin- 1- yl]- 3- methyl- 7- {2- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]ethyl}- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCN1CCN(CC1)c1nc2c(n1CCSc1nnnn1c1ccccc1)c(O)nc(=O)n2C

STK848675
Synonyms: 5- (2- hydroxyethyl)- 3- (2- hydroxyphenyl)- 4- (3- phenoxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(c2cccc(c2)Oc2ccccc2)c2c(C1=O)n[nH]c2c1ccccc1O

STK576757
Synonyms: N- (furan- 2- ylmethyl)- 5,6- dimethoxy- N- (4- methoxybenzyl)- 1H- indole- 2- carboxamide
Smiles: COc1ccc(cc1)CN(C(=O)c1cc2c([nH]1)cc(c(c2)OC)OC)Cc1ccco1

STK848678
Synonyms: 8- benzyl- 3- (2- methoxyethyl)- 1,7- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)Cc1ccccc1)C

STK576771
Synonyms: 4- {2- [(E)- (2- hydroxy- 5- oxo- 1- phenyl- 1,5- dihydro- 4H- imidazol- 4- ylidene)methyl]- 1H- pyrrol- 1- yl}benzoicacid
Smiles: OC1=N/C(=C/c2cccn2c2ccc(cc2)C(=O)O)/C(=O)N1c1ccccc1

STK576774
Synonyms: 4- (2,4- dichlorophenoxy)[1,2,4]triazolo[4,3- a]quinoxaline
Smiles: Clc1ccc(c(c1)Cl)Oc1nc2ccccc2n2c1nnc2

STK576781
Synonyms: 7- heptyl- 1,3- dimethyl- 8- [(4- phenylpiperazin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK576782
Synonyms: 2- methyl- 8- (4- methylpiperazin- 1- yl)- 3- phenyl- 6,7- dihydro- 5H- cyclopenta[d]pyrazolo[1,5- a]pyrimidine
Smiles: CN1CCN(CC1)c1c2CCCc2nc2n1nc(c2c1ccccc1)C

STK576783
Synonyms: 1- (4- chlorophenyl)- 3- (7- methyl- 2,3- dihydro- 1H- pyrrolo[2,3- b]quinolin- 1- yl)urea
Smiles: O=C(NN1CCc2c1nc1cc(C)ccc1c2)Nc1ccc(cc1)Cl

STK848683
Synonyms: N- (3- chlorophenyl)- 3- hydroxyquinoxaline- 1(2H)- carboxamide
Smiles: OC1=Nc2ccccc2N(C1)C(=O)Nc1cccc(c1)Cl

STK576784
Synonyms: 2- {(E)- [(2E)- (4,6- dimethylpyrimidin- 2(1H)- ylidene)hydrazinylidene]methyl}- 3- hydroxy- 5- methylcyclohex- 2- en- 1- one
Smiles: CC1CC(=C(C(=O)C1)/C=N/N=c\1/nc(C)cc([nH]1)C)O

STK576785
Synonyms: 2- [(2,6- dichlorobenzyl)sulfanyl]- 5- [(2S)- pyrrolidin- 2- yl]- 1,3,4- oxadiazole
Smiles: Clc1cccc(c1CSc1nnc(o1)[C@@H]1CCCN1)Cl

STK848686
Synonyms: 5- (propan- 2- ylidene)- 2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}- 1,3- thiazol- 4(5H)- one
Smiles: CC(=C1SC(=NC1=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F)C

STK576801
Synonyms: N- [2- (4- chlorophenyl)- 5- hydroxy[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]thiophene- 2- carboxamide
Smiles: Clc1ccc(cc1)c1nn2c(n1)nc(cc2NC(=O)c1cccs1)O

STK576802
Synonyms: 2- {[3- cyano- 6- (4- methoxyphenyl)- 4- (trifluoromethyl)pyridin- 2- yl]sulfanyl}- N- (4- methyl- 1,3- oxazol- 2- yl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2occ(n2)C)nc(cc1C(F)(F)F)c1ccc(cc1)OC

STK848687
Synonyms: 3- (2- hydroxyphenyl)- 4- (4- methoxyphenyl)- 5- (2- phenylethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)C1N(CCc2ccccc2)C(=O)c2c1c([nH]n2)c1ccccc1O

STK576809
Synonyms: 5- (2,4- dichlorophenyl)- 4- hydroxy- 2- (methylsulfanyl)- 5,8- dihydropyrido[2,3- d]pyrimidin- 7(6H)- one
Smiles: CSc1nc(O)c2c(n1)NC(=O)CC2c1ccc(cc1Cl)Cl

STK576813
Synonyms: 5- (benzyloxy)- 2- [4- (2- methoxyphenyl)- 1,2- oxazol- 5- yl]phenol
Smiles: COc1ccccc1c1cnoc1c1ccc(cc1O)OCc1ccccc1

STK576815
Synonyms: 1,4- bis[(4- methylphenyl)sulfonyl]- 1,2,3,4- tetrahydropyrazino[2,3- b]quinoxaline
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCN(c2c1nc1ccccc1n2)S(=O)(=O)c1ccc(cc1)C

STK576816
Synonyms: N- [4- (diethylamino)phenyl]- 6- methoxy- 1H- indole- 2- carboxamide
Smiles: CCN(c1ccc(cc1)NC(=O)c1cc2c([nH]1)cc(cc2)OC)CC

STK848689
Synonyms: ethyl4- [(6- chloro- 5,7- dimethyl- 2- oxo- 2H- chromen- 4- yl)methyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)Cc1cc(=O)oc2c1c(C)c(c(c2)C)Cl

STK576823
Synonyms: 7- hydrazinyl- 4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: NNc1ncnc2c1oc1c2c2CCCc2c(n1)C(C)C

STK576827
Synonyms: 4- chloro- N- (5- hydroxy- 2- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl)benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1cc(O)nc2n1nc(n2)c1ccccc1

STK576830
Synonyms: S- benzyl- N- {[trans- 4- ({[(7,8- dimethoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetyl]amino}methyl)cyclohexyl]carbonyl}- D- cysteine
Smiles: COc1ccc2c(c1OC)oc(=O)c(c2C)CC(=O)NC[C@@H]1CC[C@H](CC1)C(=O)N[C@@H](C(=O)O)CSCc1ccccc1

STK576833
Synonyms: 5- [(2,6- dichlorobenzyl)oxy]- 2- [5- (2- methoxyphenoxy)pyrimidin- 4- yl]phenol
Smiles: COc1ccccc1Oc1cncnc1c1ccc(cc1O)OCc1c(Cl)cccc1Cl

STK576834
Synonyms: (5E)- 5- ({[2- (diethylamino)ethyl]amino}methylidene)- 2- sulfanyl- 1- [3- (trifluoromethyl)phenyl]pyrimidine- 4,6(1H,5H)- dione
Smiles: CCN(CCN/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)S)CC

STK576836
Synonyms: N- (2- chloro- 6- fluorobenzyl)- 2- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)NCc1c(F)cccc1Cl

STK576843
Synonyms: N- [5- hydroxy- 2- (4- methylphenyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 2- phenylacetamide
Smiles: O=C(Nc1cc(O)nc2n1nc(n2)c1ccc(cc1)C)Cc1ccccc1

STK848693
Synonyms: 5- (4- methoxyphenyl)- 2- (methylsulfonyl)- 1',3'- diphenyl- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazole
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1cn(nc1c1ccccc1)c1ccccc1)S(=O)(=O)C

STK576847
Synonyms: 4- (bicyclo[2.2.1]hept- 2- yl)- 3- methylphenol
Smiles: Oc1ccc(c(c1)C)C1CC2CC1CC2

STK576852
Synonyms: 2- (3- hydroxy- 5- methyl- 4H- pyrazol- 4- yl)- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}acetohydrazide
Smiles: O=C(CC1C(=NN=C1O)C)N/N=C/c1ccc(cc1)C(C)C

STK576853
Synonyms: 2- (furan- 2- yl)- 12- (pyridin- 3- yl)- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- ol
Smiles: Oc1ccc2c(c1)Oc1c(C2c2cccnc2)c2nc(nn2cn1)c1ccco1

STK576854
Synonyms: (5- methylidene- 7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 6(5H)- yl)(3- methyl- 4- nitrophenyl)methanone
Smiles: O=C(N1CCc2c(C1=C)cc1c(c2)OCO1)c1ccc(c(c1)C)[N+](=O)[O-]

STK576857
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (4- fluorophenyl)- 5- [2- (4- methoxyphenyl)ethyl]- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(cc1)F)c([nH]n2)c1cc(Cl)c(cc1O)C

STK576858
Synonyms: 4- [2- (prop- 2- en- 1- yl)phenoxy][1,2,4]triazolo[4,3- a]quinoxaline
Smiles: C=CCc1ccccc1Oc1nc2ccccc2n2c1nnc2

STK848695
Synonyms: 2- [2- amino- 5- (4- methoxyphenoxy)pyrimidin- 4- yl]- 5- (benzyloxy)phenol
Smiles: COc1ccc(cc1)Oc1cnc(nc1c1ccc(cc1O)OCc1ccccc1)N

STK848697
Synonyms: N- {2- [(3- chlorophenyl)carbamoyl]- 1- benzofuran- 3- yl}- 6,8- dimethyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1oc2c(c1NC(=O)c1cc(=O)c3c(o1)c(C)cc(c3)C)cccc2

STK576871
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (4- ethoxyphenyl)- 5- (pyridin- 3- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCOc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(Cl)c(cc1O)C

STK848699
Synonyms: 1- benzyl- N- (3,4- dimethoxyphenyl)- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C

STK576873
Synonyms: N- [(2Z)- 3- (4- methoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]tetrahydrofuran- 2- carboxamide
Smiles: COc1ccc(cc1)CN1/C(=N/C(=O)C2CCCO2)/SC2C1CS(=O)(=O)C2

STK576874
Synonyms: 5- (benzyloxy)- 2- [5- (4- chlorophenyl)- 6- (trifluoromethyl)pyrimidin- 4- yl]phenol
Smiles: Clc1ccc(cc1)c1c(ncnc1C(F)(F)F)c1ccc(cc1O)OCc1ccccc1

STK576877
Synonyms: (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)[1- (3- fluorophenyl)cyclopentyl]methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)C1(CCCC1)c1cccc(c1)F

STK576885
Synonyms: 6- methoxy- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1H- indole- 2- carboxamide
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)NC12CC3CC(C2)CC(C1)C3

STK576886
Synonyms: 7- chloro- 1- hydroxy- 9- oxo- 9H- xanthen- 3- ylN- [(benzyloxy)carbonyl]- D- alaninate
Smiles: O=C(N[C@@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cc(cc1)Cl)C)OCc1ccccc1

STK576890
Synonyms: morpholin- 4- yl(3,3,5,5- tetramethyl- 1,3,4,5- tetrahydro- 2H- 2- benzazepin- 2- yl)methanone
Smiles: O=C(N1Cc2ccccc2C(CC1(C)C)(C)C)N1CCOCC1

STK576893
Synonyms: N- {4- [(4,6- dimethylpyrimidin- 2- yl)sulfamoyl]phenyl}- 1,9- dimethyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: Cc1cc(C)nc(n1)NS(=O)(=O)c1ccc(cc1)NC(=O)c1cc2c(n1C)nc1n(c2=O)cccc1C

STK576894
Synonyms: 2- (4- oxoquinazolin- 3(4H)- yl)- N- [4- (trifluoromethyl)phenyl]butanamide
Smiles: CCC(n1cnc2c(c1=O)cccc2)C(=O)Nc1ccc(cc1)C(F)(F)F

STK576895
Synonyms: 1- (4- fluorophenyl)- 2- (pyridin- 4- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc(cc1)C1N(Cc2ccncc2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK576901
Synonyms: N- [3- (1H- tetrazol- 1- yl)phenyl]pyridine- 4- carboxamide
Smiles: O=C(c1ccncc1)Nc1cccc(c1)n1cnnn1

STK576902
Synonyms: N- [2- hydroxy- 5- oxo- 1- (4- sulfamoylbenzyl)- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]benzamide
Smiles: OC1=NC(C(=O)N1Cc1ccc(cc1)S(=O)(=O)N)(NC(=O)c1ccccc1)C(F)(F)F

STK576903
Synonyms: 11- (4- fluorophenyl)- 3- methyl- 3,4,10,11- tetrahydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: CC1CC(=C2C(=Nc3ccccc3NC2c2ccc(cc2)F)C1)O

STK576907
Synonyms: 1- hydroxy- 9- oxo- 9H- xanthen- 3- ylN- [(benzyloxy)carbonyl]glycinate
Smiles: O=C(OCc1ccccc1)NCC(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1

STK576911
Synonyms: 2- {2- [(1- amino- 7- cyclohexyl- 6,7,8,9- tetrahydro- 3H- pyrazolo[3,4- c][2,7]naphthyridin- 5- yl)amino]ethoxy}ethanol
Smiles: OCCOCCNc1nc2[nH]nc(c2c2c1CN(CC2)C1CCCCC1)N

STK576916
Synonyms: 1- [3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanoyl]- L- proline
Smiles: OC(=O)[C@@H]1CCCN1C(=O)CCn1nnc2c(c1=O)cccc2

STK576917
Synonyms: 5- ({[(5Z)- 5- (4- fluorobenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]acetyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(CN1C(=O)S/C(=C\c2ccc(cc2)F)/C1=O)Nc1ccc(c(c1)C(=O)O)O

STK576919
Synonyms: N- [(1Z)- 1- {1- cyano- 2- [(3- methylphenyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]pyridine- 3- carboxamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cccnc1)/C(=O)Nc1cccc(c1)C

STK848703
Synonyms: 3- [(3- chloro- 4- fluorophenyl)amino]- 2- benzofuran- 1(3H)- one
Smiles: O=C1OC(c2c1cccc2)Nc1ccc(c(c1)Cl)F

STK576921
Synonyms: N- {7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 1,3- dimethyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl}glycine
Smiles: OC(=O)CNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(=O)n(c(=O)n2C)C

STK576922
Synonyms: 7- (4- benzylpiperazin- 1- yl)- 5- methyl- 2- (trifluoromethyl)[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Cc1cc(N2CCN(CC2)Cc2ccccc2)n2c(n1)nc(n2)C(F)(F)F

STK576925
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,5- dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK848705
Synonyms: (2Z)- 3- oxo- 2- (pyridin- 3- ylmethylidene)- 2,3- dihydro- 1- benzofuran- 6- yl4- nitrobenzoate
Smiles: O=C1/C(=C/c2cccnc2)/Oc2c1ccc(c2)OC(=O)c1ccc(cc1)[N+](=O)[O-]

STK576933
Synonyms: (4E)- 2- (5- bromopyridin- 2- yl)- 4- (ethoxymethylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: CCO/C=C\1/C(=O)N(c2ccc(cn2)Br)C(=O)c2c1cccc2

STK576936
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 6- methyl- 5- pentylpyrimidin- 4- ol
Smiles: CCCCCc1c(C)nc(nc1O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK576940
Synonyms: ethyl4- [(3- {4- [(4- ethenylbenzyl)oxy]- 2- hydroxyphenyl}- 1H- pyrazol- 4- yl)oxy]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Oc1c[nH]nc1c1ccc(cc1O)OCc1ccc(cc1)C=C

STK848709
Synonyms: 7- (benzylsulfanyl)- 3- (4- chlorophenyl)- 2- hydroxypyrimido[4,5- d]pyrimidin- 4(3H)- one
Smiles: Clc1ccc(cc1)n1c(O)nc2c(c1=O)cnc(n2)SCc1ccccc1

STK576948
Synonyms: N- {[4- (propan- 2- yl)phenyl]carbamoyl}- L- alanine
Smiles: C[C@@H](C(=O)O)NC(=O)Nc1ccc(cc1)C(C)C

STK576955
Synonyms: N'- [3- (2- methoxyphenyl)- 2,5- dimethylpyrazolo[1,5- a]pyrimidin- 7- yl]- N,N- dimethylethane- 1,2- diamine
Smiles: COc1ccccc1c1c(C)nn2c1nc(C)cc2NCCN(C)C

STK848711
Synonyms: 2- [2- amino- 5- (3,4- dimethoxyphenyl)pyrimidin- 4- yl]- 5- [(4- fluorobenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1)F)N

STK848713
Synonyms: 2- {[5- (5- methyl- 1,2- oxazol- 3- yl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}- N- [(2E)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: Cc1onc(c1)c1nnc(o1)SCC(=O)/N=c\1/scc([nH]1)C

STK576963
Synonyms: 7'- nitro- 1- phenyl- 1',2',3',3a'- tetrahydro- 3H,5H,5'H- spiro[pyrazolidine- 4,4'- pyrrolo[1,2- a]quinoline]- 3,5- dione
Smiles: [O-][N+](=O)c1ccc2c(c1)CC1(C3N2CCC3)C(=O)NN(C1=O)c1ccccc1

STK576966
Synonyms: 2- (4- bromophenyl)- 6- (4- methoxyphenyl)- 6,7- dihydroimidazo[2,1- b][1,3]benzothiazol- 8(5H)- one
Smiles: COc1ccc(cc1)C1CC(=O)c2c(C1)n1cc(nc1s2)c1ccc(cc1)Br

STK848715
Synonyms: 8- (2- methoxyphenyl)- 3- (4- methoxyphenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: COc1ccc(cc1)N1CSC2=C(C#N)C(CC(=O)N2C1)c1ccccc1OC

STK576972
Synonyms: (2Z)- 6- [(2,4- dichlorobenzyl)oxy]- 2- [(2- methyl- 2H- chromen- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: Clc1ccc(c(c1)Cl)COc1ccc2c(c1)O/C(=C\C1=Cc3ccccc3OC1C)/C2=O

STK576983
Synonyms: 5- (5- chloro- 2- hydroxyphenyl)- N- (5- ethyl- 1,3,4- thiadiazol- 2- yl)- 1H- pyrazole- 3- carboxamide
Smiles: CCc1nnc(s1)NC(=O)c1n[nH]c(c1)c1cc(Cl)ccc1O

STK576985
Synonyms: 3- (2,4- dimethoxyphenyl)- 7- phenyl- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: COc1cc(OC)ccc1C1=NOC2(C1)CC(=O)N(C2=O)c1ccccc1

STK576988
Synonyms: 5,6- dimethyl- N- [2- (morpholin- 4- yl)ethyl]furo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1c(C)oc2c1c(NCCN1CCOCC1)ncn2

STK576989
Synonyms: 2- {[(5E)- 5- (acetylimino)- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N- (4- chlorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1n[nH]/c(=N\C(=O)C)/s1

STK576996
Synonyms: 12- (furan- 2- yl)- 3- (4- methoxyphenyl)- 2,3,4,12- tetrahydrobenzimidazo[2,1- b]quinazolin- 1- ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccco2)c2c(n3)cccc2)C1)O

STK577005
Synonyms: 6- methyl- 9- (pyridin- 3- yl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CC1CC(=C2C(=Nc3n(C2c2cccnc2)ncn3)C1)O

STK577010
Synonyms: 5- [(3,4- dichlorobenzyl)oxy]- 2- [5- (2- methoxyphenyl)pyrimidin- 4- yl]phenol
Smiles: COc1ccccc1c1cncnc1c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl

STK848724
Synonyms: 1- methyl- 4- oxo- N- (pyridin- 3- yl)- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: O=c1c2cc(n(c2nc2n1cccc2)C)C(=O)Nc1cccnc1

STK848726
Synonyms: N- [4- (propan- 2- ylsulfamoyl)phenyl]- 2- (thiophen- 2- yl)acetamide
Smiles: CC(NS(=O)(=O)c1ccc(cc1)NC(=O)Cc1cccs1)C

STK577020
Synonyms: 6- chloro- 7- methyl- 4- oxo- N- [(2Z)- 5- (prop- 2- en- 1- ylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4H- chromene- 2- carboxamide
Smiles: C=CCSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)/s1

STK848728
Synonyms: (4E)- 4- {[(4- methoxyphenyl)amino]methylidene}- 5- methyl- 2- phenyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc(cc1)N/C=C/1\C(=NN(C1=O)c1ccccc1)C

STK577023
Synonyms: 2- (furan- 2- yl)- 12- (2- methoxyphenyl)- 9,9- dimethyl- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccccc1C1C2=C(Oc3c1c1nc(nn1cn3)c1ccco1)CC(CC2=O)(C)C

STK577025
Synonyms: N- [2- (cyclohex- 1- en- 1- yl)ethyl]- 6- methoxy- 1H- indole- 2- carboxamide
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)NCCC1=CCCCC1

STK577026
Synonyms: 2- [(4- ethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (4- sulfamoylbenzyl)propanamide
Smiles: CCc1cc(=O)oc2c1ccc(c2)OC(C(=O)NCc1ccc(cc1)S(=O)(=O)N)C

STK577027
Synonyms: 5- (3- fluorophenyl)- 7- hydroxy- 1- methyl- 2- (methylsulfanyl)- 5,6- dihydropyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: CSc1nc(=O)c2c(n1C)N=C(CC2c1cccc(c1)F)O

STK577030
Synonyms: 5,7,8- trimethyl- 4- [(4- methylpiperidin- 1- yl)methyl]- 2H- chromen- 2- one
Smiles: CC1CCN(CC1)Cc1cc(=O)oc2c1c(C)cc(c2C)C

STK577032
Synonyms: N- (1H- indol- 3- ylacetyl)alanine
Smiles: O=C(Cc1c[nH]c2c1cccc2)NC(C(=O)O)C

STK577034
Synonyms: 3- ethyl- 8- ({(Z)- [4- hydroxy- 2,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}amino)- 1',3'- dimethyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2'
Smiles: C=CCN1C(=O)N=C(/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)CC)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK577039
Synonyms: 7- chloro- 1- hydroxy- 3- [(3- oxobutan- 2- yl)oxy]- 9H- xanthen- 9- one
Smiles: CC(=O)C(Oc1cc(O)c2c(c1)oc1c(c2=O)cc(cc1)Cl)C

STK577043
Synonyms: 3- (5- fluoro- 2- hydroxyphenyl)- 5- [2- (4- methoxyphenyl)ethyl]- 4- phenyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccccc1)c([nH]n2)c1cc(F)ccc1O

STK848731
Synonyms: 2- [2- amino- 5- (2- bromophenoxy)pyrimidin- 4- yl]- 5- (benzyloxy)phenol
Smiles: Nc1ncc(c(n1)c1ccc(cc1O)OCc1ccccc1)Oc1ccccc1Br

STK577044
Synonyms: (5E)- 6- hydroxy- 3- (2- methylphenyl)- 5- (1- {[3- (morpholin- 4- yl)propyl]amino}propylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/NCCCN1CCOCC1

STK577049
Synonyms: (1'S,3R,3'S,7a'S)- 5''- ethyl- 1'- [(4- fluorophenyl)carbonyl]- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: CCc1ccc2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)F

STK577050
Synonyms: 2- [2- amino- 5- (2- methoxyphenoxy)pyrimidin- 4- yl]- 5- [(2,6- dichlorobenzyl)oxy]phenol
Smiles: COc1ccccc1Oc1cnc(nc1c1ccc(cc1O)OCc1c(Cl)cccc1Cl)N

STK577051
Synonyms: 3- (3- chlorophenyl)- 10- methyl- 6- propyl- 3,4- dihydro- 2H,8H- chromeno[6,7- e][1,3]oxazin- 8- one
Smiles: CCCc1cc(=O)oc2c1cc1CN(COc1c2C)c1cccc(c1)Cl

STK577053
Synonyms: (1Z)- 1- {[(4- chlorophenyl)sulfonyl]methylidene}- 6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2c(cc1OC)CCN/C/2=C\S(=O)(=O)c1ccc(cc1)Cl

STK577055
Synonyms: 2- (pyridin- 2- yl)- 1- (pyridin- 4- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: O=C1N(c2ccccn2)C(c2c1oc1ccccc1c2=O)c1ccncc1

STK577056
Synonyms: (2S)- 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- 3- phenyl- N- propylpropanamide
Smiles: CCCNC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)Cc1ccccc1

STK577057
Synonyms: 6,7- dimethoxy- 1- methyl- 2- (thiophen- 2- ylsulfonyl)- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2c(cc1OC)CCN(C2C)S(=O)(=O)c1cccs1

STK577058
Synonyms: 3,6,6- trimethyl- N- [2- (morpholin- 4- yl)ethyl]- 4- oxo- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)NCCN1CCOCC1

STK577061
Synonyms: N'- [(3E)- 1- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]acetohydrazide
Smiles: COc1ccc2c(c1OC)C(=O)OC2N1C(=O)/C(=N/NC(=O)C)/c2c1cccc2

STK577063
Synonyms: 4- {[(phthalazin- 1- ylsulfanyl)acetyl]amino}benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CSc1nncc2c1cccc2

STK848733
Synonyms: 7- (2,5- dimethylphenyl)- 2- (pyridin- 3- yl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1ccc(c(c1)n1ncc2c1ncn1c2nc(n1)c1cccnc1)C

STK848736
Synonyms: 1- [2- (3,4- dimethoxyphenyl)ethyl]- 8- methyl- 2,5- dioxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carbonitrile
Smiles: N#Cc1cc2c(n(c1=O)CCc1ccc(c(c1)OC)OC)nc1n(c2=O)cc(cc1)C

STK848737
Synonyms: N- (4- chlorophenyl)- 1,7- dimethyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc2c(n1C)nc1n(c2=O)cc(cc1)C

STK577071
Synonyms: 2- (7,8- dihydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (2- methylcyclohexyl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2O)O)NC1CCCCC1C

STK848738
Synonyms: (5Z)- 5- (5- bromo- 2- thioxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 4- hydroxy- 1,3- thiazol- 2(5H)- one
Smiles: Brc1ccc2c(c1)/C(=C\1/SC(=O)N=C1O)/C(=S)N2

STK577079
Synonyms: 1- (4- chlorophenyl)- 2- [2- (4- methoxyphenyl)ethyl]- 5,7- dimethyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(cc1)Cl)c(=O)c1c(o2)c(C)cc(c1)C

STK577082
Synonyms: 4- [4- (benzyloxy)- 3- ethoxyphenyl]- 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- (2- hydroxyethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1ccc(c(c1)OCC)OCc1ccccc1)c([nH]n2)c1cc(C)cc(c1O)C

STK577086
Synonyms: 9- [4- (diethylamino)phenyl]- 2- (methylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CSc1nc2n(n1)C(c1ccc(cc1)N(CC)CC)C1=C(O)CCCC1=N2

STK577087
Synonyms: 3- (2- hydroxyphenyl)- 3,4- dihydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: OC1=C2C=Nc3c(N=C2CC(C1)c1ccccc1O)cccc3

STK577090
Synonyms: 4- {[4- (3- chlorophenyl)piperazin- 1- yl]methyl}- 6- ethyl- 2H- chromen- 2- one
Smiles: CCc1ccc2c(c1)c(CN1CCN(CC1)c1cccc(c1)Cl)cc(=O)o2

STK577093
Synonyms: 4- (4- ethoxyphenyl)- 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- [2- (4- methoxyphenyl)ethyl]- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCOc1ccc(cc1)C1N(CCc2ccc(cc2)OC)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C

STK577096
Synonyms: 5- methyl- 6- (3- methylbutyl)- 2- (trifluoromethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CC(CCc1c(C)nc2n(c1O)nc(n2)C(F)(F)F)C

STK577098
Synonyms: ethyl4- [(3- {4- [(2- fluorobenzyl)oxy]- 2- hydroxyphenyl}- 1H- pyrazol- 4- yl)oxy]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Oc1c[nH]nc1c1ccc(cc1O)OCc1ccccc1F

STK577101
Synonyms: (5Z)- 5- ({3- [2- methyl- 4- (2- methylpropoxy)phenyl]- 1- phenyl- 1H- pyrazol- 4- yl}methylidene)- 3- (propan- 2- yl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CC(COc1ccc(c(c1)C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C(C)C)c1ccccc1)C

STK577102
Synonyms: 1- benzyl- 3- [(2Z)- 6- methoxy- 1,3- benzothiazol- 2(3H)- ylidene]thiourea
Smiles: COc1ccc2c(c1)s/c(=N\C(=S)NCc1ccccc1)/[nH]2

STK577103
Synonyms: (2Z)- 2- (2- chloro- 6- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl3- nitrobenzoate
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Oc1ccc2c(c1)O/C(=C\c1c(F)cccc1Cl)/C2=O

STK848742
Synonyms: (2Z)- 2- (3- methylbenzylidene)- 6- (2- oxopropoxy)- 1- benzofuran- 3(2H)- one
Smiles: CC(=O)COc1ccc2c(c1)O/C(=C\c1cccc(c1)C)/C2=O

STK577107
Synonyms: methyl4- ({5- [4- (2- hydrazinyl- 2- oxoethoxy)- 2- hydroxyphenyl]- 1H- pyrazol- 4- yl}oxy)benzoate
Smiles: NNC(=O)COc1ccc(c(c1)O)c1[nH]ncc1Oc1ccc(cc1)C(=O)OC

STK848743
Synonyms: N- [(5Z)- 5- (1H- benzimidazol- 2- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- 2- hydroxybenzamide
Smiles: S=C1S/C(=C\c2nc3c([nH]2)cccc3)/C(=O)N1NC(=O)c1ccccc1O

STK577108
Synonyms: 3- ([1]benzofuro[3,2- d]pyrimidin- 4- ylamino)benzoicacid
Smiles: OC(=O)c1cccc(c1)Nc1ncnc2c1oc1c2cccc1

STK577114
Synonyms: (4Z)- 4- (hydroxyimino)- 3,6,6- trimethyl- N- (2,2,6,6- tetramethylpiperidin- 4- yl)- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O/N=C\1/CC(C)(C)Cc2c1c(C)c(o2)C(=O)NC1CC(C)(C)NC(C1)(C)C

STK577120
Synonyms: methylN- {[3- chloro- 4- (4- methylpiperazin- 1- yl)phenyl]carbamoyl}- L- methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)Nc1ccc(c(c1)Cl)N1CCN(CC1)C

STK577121
Synonyms: N- [(4- chlorophenyl)carbonyl]- 3- (2- hydroxyquinolin- 4- yl)alanine
Smiles: Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(O)nc2c1cccc2

STK577122
Synonyms: 3- (2,4- dimethoxyphenyl)- 3,4- dihydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: COc1ccc(c(c1)OC)C1CC(=C2C(=Nc3ccccc3N=C2)C1)O

STK577124
Synonyms: ethyl4- [(3a'S,6a'R)- 3'- (1H- indol- 3- ylmethyl)- 5,7- dimethyl- 2,4',6'- trioxo- 1,2,2',3',3a',4',6',6a'- octahydro- 5'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 5'- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(C)cc2C

STK577126
Synonyms: 8- [(2E)- 2- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)hydrazinyl]- 6- hydroxy- 7- [2- hydroxy- 3- (3- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC1=NC(=O)/C(=N/Nc2nc3c(n2CC(COc2cccc(c2)C)O)c(O)nc(=O)n3C)/C(=N1)O

STK577132
Synonyms: 7- (3- fluorophenyl)- N- (2- methoxyphenyl)- 5- methyl- 2- (methylsulfanyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine- 6- carboxamide
Smiles: COc1ccccc1NC(=O)C1=C(C)N=c2n(C1c1cccc(c1)F)nc([nH]2)SC

STK577135
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C

STK577137
Synonyms: N- (3- chloro- 2- methylphenyl)- 5- (2- hydroxyphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccccc1O)Nc1cccc(c1C)Cl

STK577143
Synonyms: 1- (3- fluorophenyl)- 2- (furan- 2- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1cccc(c1)C1N(Cc2ccco2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK577144
Synonyms: 10- methyl- 1- (5- methyl- 1,2- oxazol- 3- yl)- 2,5- dioxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carbonitrile
Smiles: N#Cc1cc2c(n(c1=O)c1noc(c1)C)nc1n(c2=O)cccc1C

STK577151
Synonyms: (5Z)- 5- [(1- methyl- 1H- pyrrol- 2- yl)methylidene]- 2- {[2- (trifluoromethyl)phenyl]amino}- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C\c1cccn1C)Nc1ccccc1C(F)(F)F

STK577157
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (3,4- dimethoxyphenyl)- 5- (pyridin- 3- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1cc(ccc1OC)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(Cl)c(cc1O)C

STK577165
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (3- ethoxy- 4- hydroxyphenyl)- 5- (4- methoxybenzyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCOc1cc(ccc1O)C1N(Cc2ccc(cc2)OC)C(=O)c2c1c([nH]n2)c1cc(Cl)c(cc1O)C

STK577170
Synonyms: (4Z)- 5- hydroxy- 4- [(6- methoxy- 4- oxo- 4H- chromen- 3- yl)methylidene]- 2- phenyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc2c(c1)c(=O)c(co2)/C=C\1/C(=NN(C1=O)c1ccccc1)O

STK577173
Synonyms: N- [5- (4- bromophenyl)- 7- (4- methoxyphenyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]methanesulfonamide
Smiles: COc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)NS(=O)(=O)C)c1ccc(cc1)Br

STK577174
Synonyms: (5Z)- 5- [2- (4- benzylpiperazin- 1- yl)- 5- nitrobenzylidene]- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C\c2cc(ccc2N2CCN(CC2)Cc2ccccc2)[N+](=O)[O-])/C(=N1)O

STK577176
Synonyms: (1E)- 1- phenyl- N- [(9- propyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)methoxy]ethanimine
Smiles: CCCN1CCc2c(C1)sc1c2c2nc(nn2cn1)CO/N=C(/c1ccccc1)\C

STK577177
Synonyms: 3- [3- (dimethylamino)propyl]- 4- imino- 5- (2- methoxyphenyl)- 3,5- dihydro- 4H- chromeno[2,3- d]pyrimidin- 8- ol
Smiles: COc1ccccc1C1c2ccc(cc2Oc2c1c(=N)n(cn2)CCCN(C)C)O

STK577179
Synonyms: N- [2- hydroxy- 5- oxo- 1- (3- phenylpropyl)- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]- 3- (4- methoxyphenyl)propanamide
Smiles: COc1ccc(cc1)CCC(=O)NC1(N=C(N(C1=O)CCCc1ccccc1)O)C(F)(F)F

STL036518
Synonyms: N- [(2E)- 6- fluoro- 1,3- benzothiazol- 2(3H)- ylidene]- 6,8- dimethyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Fc1ccc2c(c1)s/c(=N/C(=O)c1cc(=O)c3c(o1)c(C)cc(c3)C)/[nH]2

STK577188
Synonyms: 4- imino- 2- [4- (methylsulfanyl)phenyl]- 6,7- dihydro- 4H- [1,3]dioxolo[4,5- g]pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc2OCOc2c1)c1ccc(cc1)SC

STK848747
Synonyms: 2,8,10- trimethyl- N- (3- methylphenyl)pyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidin- 4- amine
Smiles: Cc1cccc(c1)Nc1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK848748
Synonyms: 3- (2,4- dimethoxyphenyl)- 2- oxo- 2H- chromen- 7- ylmorpholine- 4- carboxylate
Smiles: COc1ccc(c(c1)OC)c1cc2ccc(cc2oc1=O)OC(=O)N1CCOCC1

STK577195
Synonyms: 7- fluoro- 1- (4- methoxyphenyl)- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK577196
Synonyms: N- benzyl- N- ethyl- 6- methoxy- 1H- indole- 2- carboxamide
Smiles: CCN(C(=O)c1cc2c([nH]1)cc(cc2)OC)Cc1ccccc1

STK577200
Synonyms: 2- [(2,3- dichlorophenyl)amino]- 4- (2- methoxyphenyl)- 8- methyl- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: COc1ccccc1C1N=C(Nc2cccc(c2Cl)Cl)N=c2n1c(=O)cc([nH]2)C

STK577204
Synonyms: 2- [(2Z)- 1,3- benzoxazol- 2(3H)- ylideneamino]- N- (2- methoxyphenyl)- 6- methyl- 4- phenyl- 1,4- dihydropyrimidine- 5- carboxamide
Smiles: COc1ccccc1NC(=O)C1=C(C)NC(=NC1c1ccccc1)/N=c/1\oc2c([nH]1)cccc2

STK577206
Synonyms: 5- (2- hydroxyphenyl)- N- {4- [methyl(phenyl)sulfamoyl]phenyl}- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccccc1O)Nc1ccc(cc1)S(=O)(=O)N(c1ccccc1)C

STK577208
Synonyms: 2- [2- amino- 5- (4- methoxyphenyl)pyrimidin- 4- yl]- 5- [(2,4- dichlorobenzyl)oxy]phenol
Smiles: COc1ccc(cc1)c1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1Cl)Cl)N

STK577210
Synonyms: 3- (ethylsulfanyl)- 8,8- dimethyl- 5- (phenylamino)- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridine- 6- carbonitrile
Smiles: CCSc1nnc2n1c(Nc1ccccc1)c(C#N)c1c2COC(C1)(C)C

STK577212
Synonyms: 8,10- dimethyl- N- (3- methylbutyl)- 2- propylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidin- 4- amine
Smiles: CCCc1cc(NCCC(C)C)n2c(n1)c1c(C)cc(nc1n2)C

STK577213
Synonyms: 7- (2- methylphenyl)- 3- phenyl- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Cc1ccccc1n1ncc2c1ncn1c2nnc1c1ccccc1

STK848751
Synonyms: N- [4- (4- chlorophenyl)- 1,2,5- oxadiazol- 3- yl]- 2- (4- fluorophenoxy)acetamide
Smiles: O=C(Nc1nonc1c1ccc(cc1)Cl)COc1ccc(cc1)F

STK577215
Synonyms: 4- chloro- N- [(2Z)- 5- [(4- fluorobenzyl)sulfonyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: Fc1ccc(cc1)CS(=O)(=O)c1n[nH]/c(=N/C(=O)c2ccc(cc2)Cl)/s1

STK577219
Synonyms: 1,3- dimethyl- 5- [1- (2- phenylhydrazinyl)ethylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CN1C(=O)N(C)C(=O)C(=C(NNc2ccccc2)C)C1=O

STK577224
Synonyms: 3- (4- chlorophenyl)- 1- [3- (dimethylamino)propyl]- 7- methyl- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: CN(CCCn1c(=O)n(c2ccc(cc2)Cl)c(=O)c2c1sc1c2CCN(C1)C)C

STK577227
Synonyms: 4- [(4E)- 4- (furan- 2- ylmethylidene)- 5- oxo- 2- phenyl- 4,5- dihydro- 1H- imidazol- 1- yl]benzoicacid
Smiles: O=C1/C(=C\c2ccco2)/N=C(N1c1ccc(cc1)C(=O)O)c1ccccc1

STK848755
Synonyms: 3- benzyl- 2- ethyl- 8- methoxy- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)c(=O)n(c(n1)CC)Cc1ccccc1

STK577232
Synonyms: 5- (5- chloro- 2- hydroxyphenyl)- N- {4- [(2- methylpiperidin- 1- yl)sulfonyl]phenyl}- 1H- pyrazole- 3- carboxamide
Smiles: Clc1ccc(c(c1)c1[nH]nc(c1)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCCC1C)O

STK577234
Synonyms: N- cyclopentyl- 3,4- dihydro- 2H- 1,5,3- benzodioxaphosphepin- 3- amine3- oxide
Smiles: O=P1(COc2c(OC1)cccc2)NC1CCCC1

STK577236
Synonyms: 1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl[2- (4- methoxyphenyl)quinolin- 4- yl]methanone
Smiles: COc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)N1CCC2(CC1)OCCO2

STK577241
Synonyms: methylN- (morpholin- 4- ylcarbonyl)- L- phenylalaninate
Smiles: COC(=O)[C@@H](NC(=O)N1CCOCC1)Cc1ccccc1

STK848759
Synonyms: 2- phenyl- 5- propyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCCc1cc(O)n2c(n1)nc(n2)c1ccccc1

STK577247
Synonyms: N- (3- chlorophenyl)- 4,5,6,7- tetrahydro- 2H- indazole- 3- carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1[nH]nc2c1CCCC2

STK577249
Synonyms: ethyl4- [(3a'S,6a'R)- 5- fluoro- 3'- (4- hydroxybenzyl)- 2,4',6'- trioxo- 1,2,2',3',3a',4',6',6a'- octahydro- 5'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 5'- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(F)cc2

STK577250
Synonyms: 3- [(Z)- (4- hydroxy- 2- thioxo- 1,3- thiazol- 5(2H)- ylidene)methyl]- 6- methoxy- 4H- chromen- 4- one
Smiles: COc1cc2c(=O)c(/C=C/3\SC(=S)N=C3O)coc2cc1

STK577251
Synonyms: 1- (3- bromopropyl)- 4- hydroxypyrimidin- 2(1H)- one
Smiles: Oc1ccn(c(=O)n1)CCCBr

STK577252
Synonyms: 4- (4- tert- butylphenyl)- 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 5- (3- hydroxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1ccc(cc1)C(C)(C)C)c([nH]n2)c1cc(Cl)c(cc1O)C

STK577254
Synonyms: 2- amino- 6- hydroxy- 5- (4- methoxyphenyl)- 8,8- dimethyl- 5,7,8,9- tetrahydropyrimido[4,5- b]quinolin- 4(3H)- one
Smiles: COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(=O)[nH]c(n2)N)(C)C

STK577259
Synonyms: N- (2,3- dimethylphenyl)- 2- [(1- hydroxy- 5- methyl- 9- oxo- 9H- xanthen- 3- yl)oxy]acetamide
Smiles: O=C(Nc1cccc(c1C)C)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK577260
Synonyms: 7- (2- ethoxyethyl)- 8- {[4- (2- hydroxyethyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCN1CCN(CC1)Cc1nc2c(n1CCOCC)c(=O)n(c(=O)n2C)C

STK577265
Synonyms: 2- (ethylsulfonyl)- 6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)S(=O)(=O)CC

STK577268
Synonyms: 4- (3- bromophenyl)- 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 5- (2- hydroxyethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)Br)c([nH]n2)c1cc(Cl)c(cc1O)C

STK577275
Synonyms: 4- amino- N- (2- methylpropyl)- 3- phenyl- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: CC(CNC(=O)c1sc(=S)n(c1N)c1ccccc1)C

STK577277
Synonyms: 4- {[(E)- (2,4- dimethoxyphenyl)methylidene]amino}- 5- (pyridin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(OC)ccc1/C=N/n1c(=S)[nH]nc1c1ccccn1

STK577280
Synonyms: 12- (2- methoxyphenyl)- 9,9- dimethyl- 2- (pyridin- 4- yl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccccc1C1C2=C(Oc3c1c1nc(nn1cn3)c1ccncc1)CC(CC2=O)(C)C

STK577283
Synonyms: 5- chloro- N- [3- (2- oxopyrrolidin- 1- yl)propyl]- 1H- indole- 2- carboxamide
Smiles: Clc1ccc2c(c1)cc([nH]2)C(=O)NCCCN1CCCC1=O

STK577284
Synonyms: 4- {[(3- methoxypropyl)amino]methyl}quinolin- 2- ol
Smiles: COCCCNCc1cc(O)nc2c1cccc2

STK577286
Synonyms: ethyl[(2Z)- 2- {[(2E)- 3- (2,5- dimethoxyphenyl)prop- 2- enoyl]imino}- 2,3- dihydro- 1,3- thiazol- 4- yl]acetate
Smiles: CCOC(=O)Cc1cs/c(=N\C(=O)/C=C/c2cc(OC)ccc2OC)/[nH]1

STK577290
Synonyms: 2- ethyl- 4- hydroxy- N- (5- methyl- 1,2- oxazol- 3- yl)- 2H- 1,2- benzothiazine- 3- carboxamide1,1- dioxide
Smiles: CCN1C(=C(O)c2c(S1(=O)=O)cccc2)C(=O)Nc1noc(c1)C

STK577292
Synonyms: 14- (4- fluorophenyl)- 2,3,4,6,7,14- hexahydro- 1H- [1,3]dioxolo[6,7]isoquino[2,1- a]quinolin- 1- one
Smiles: Fc1ccc(cc1)C1C=C2N(C3=C1C(=O)CCC3)CCc1c2cc2OCOc2c1

STK577293
Synonyms: 3,4- dihydroisoquinolin- 2(1H)- yl(5- methoxy- 3- methyl- 1H- indol- 2- yl)methanone
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)N1CCc2c(C1)cccc2

STK577294
Synonyms: 1- benzyl- 9- methyl- N- (3- methylphenyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C

STK577299
Synonyms: (5Z)- 3- (4- fluorobenzyl)- 5- {[5- (3- fluorophenyl)furan- 2- yl]methylidene}- 2- hydroxy- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: Fc1ccc(cc1)CN1C(=N/C(=C\c2ccc(o2)c2cccc(c2)F)/C1=O)O

STK577303
Synonyms: 8- [4- (2- chloro- 6- fluorobenzyl)piperazin- 1- yl]- 6- hydroxy- 3- methyl- 7- (2- methylprop- 2- en- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(=C)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1c(F)cccc1Cl

STK577304
Synonyms: (5Z)- 1- cyclopropyl- 5- {[(2',6'- dihydroxy- 3- methyl- 4'- oxo- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidin]- 8- yl)amino]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)N/C=C\2/C(=O)N=C(N(C2=O)C2CC2)S)C(=NC(=NC1=O)O)O

STK577305
Synonyms: N- cyclohexyl- 2- methyl- 3- phenyl- 5- propylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CCCc1cc(NC2CCCCC2)n2c(n1)c(c1ccccc1)c(n2)C

STK577309
Synonyms: ethyl4- ({(6Z)- 4- amino- 6- [(4- methylphenyl)imino]- 1,6- dihydro- 1,3,5- triazin- 2- yl}methyl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)Cc1nc(N)n/c(=N\c2ccc(cc2)C)/[nH]1

STK577310
Synonyms: (5s,7s)- 5- ethyl- 7- methyl- 2- (5- nitrofuran- 2- yl)- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1ccc(o1)[N+](=O)[O-])C

STK577315
Synonyms: 6- hydroxy- 3- methyl- 8- [(4- methylpiperazin- 1- yl)methyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: CN1CCN(CC1)Cc1[nH]c2c(n1)n(C)c(=O)nc2O

STK848771
Synonyms: 3,6,6- trimethyl- 4- oxo- N- (pyridin- 3- ylmethyl)- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)NCc1cccnc1

STK577318
Synonyms: N- (2,4- dimethoxyphenyl)- 2- {[2- (4- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2ccc(cc2OC)OC)c2c(n1)CC(OC2)(C)C

STK577324
Synonyms: 6- chloro- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Clc1ccc2c(c1)c(=O)cc(o2)C(=O)NC1CCS(=O)(=O)C1

STK577325
Synonyms: (5,6- dimethoxy- 1H- indol- 2- yl)[4- (2- methoxyphenyl)piperazin- 1- yl]methanone
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)N1CCN(CC1)c1ccccc1OC

STK577328
Synonyms: (4E)- 2- (2,5- dichlorophenyl)- 4- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: Clc1ccc(c(c1)N1C(=O)/C(=C/NCCCN2CCOCC2)/c2c(C1=O)cccc2)Cl

STK577333
Synonyms: 3- (2- methoxyphenyl)- 5- methyl- 7- (4- methylpiperazin- 1- yl)pyrazolo[1,5- a]pyrimidine
Smiles: COc1ccccc1c1cnn2c1nc(C)cc2N1CCN(CC1)C

STK577337
Synonyms: 2- (2- chlorophenyl)- 12- (furan- 2- yl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: O=C1CCCC2=C1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1ccccc1Cl

STK577338
Synonyms: N- benzyl- 6- methoxy- 1H- indole- 2- carboxamide
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)NCc1ccccc1

STK577339
Synonyms: 5- [(4- fluorobenzyl)oxy]- 2- [4- (2- methoxyphenyl)- 1,2- oxazol- 5- yl]phenol
Smiles: COc1ccccc1c1cnoc1c1ccc(cc1O)OCc1ccc(cc1)F

STK577341
Synonyms: 2- (4- chlorophenyl)- 7- (4- fluorophenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Fc1ccc(cc1)n1ncc2c1ncn1c2nc(n1)c1ccc(cc1)Cl

STK848781
Synonyms: 1- (3- methoxypropyl)- 4- oxo- N- phenyl- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)Nc1ccccc1

STK577344
Synonyms: 9,10- dimethoxy- 2- [(2- methylphenyl)amino]- 6,7- dihydro- 4H- pyrimido[6,1- a]isoquinolin- 4- one
Smiles: COc1cc2c(cc1OC)CCn1c2cc(Nc2ccccc2C)nc1=O

STK577345
Synonyms: 2'- amino- 5',6'- dimethyl- 3,4'- bipyridine- 3'- carbonitrile
Smiles: N#Cc1c(N)nc(c(c1c1cccnc1)C)C

STK577349
Synonyms: N- (furan- 2- ylmethyl)- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]tetrahydrofuran- 2- carboxamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)C1CCCO1)Cc1ccco1

STK848783
Synonyms: 3- benzyl- 8- (2,3- dimethoxyphenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1cccc(c1OC)OC)Cc1ccccc1

STK577352
Synonyms: 5- methoxy- 3- {[(2- methoxy- 5- methylphenyl)sulfonyl]amino}- 1H- indole- 2- carboxylicacid
Smiles: COc1ccc2c(c1)c(NS(=O)(=O)c1cc(C)ccc1OC)c([nH]2)C(=O)O

STK577356
Synonyms: N- {4- [(6- benzyl- 2,5- dimethyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- yl)amino]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1c(Cc2ccccc2)c(C)nc2n1nc(c2c1ccccc1)C

STK577358
Synonyms: 9- (3,5- difluorophenyl)- 6,6- dimethyl- 2- (methylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CSc1nn2c(n1)N=C1C(=C(O)CC(C1)(C)C)C2c1cc(F)cc(c1)F

STK577360
Synonyms: 2- [(4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 3- ylmethyl)propanamide
Smiles: O=C(C(Oc1ccc2c(c1)oc(=O)cc2C)C)NCc1cccnc1

STK848785
Synonyms: 7- methyl- N- [3- (methylcarbamoyl)- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl]- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: CNC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)cc(cc3)C)sc2c1CCCC2

STK577366
Synonyms: 2- (5- chlorothiophen- 2- yl)- 8,9- dimethoxy- 5,6- dihydropyrrolo[2,1- a]isoquinoline
Smiles: COc1cc2c(cc1OC)CCn1c2cc(c1)c1ccc(s1)Cl

STK577368
Synonyms: N- [(3- bromophenyl)carbamoyl]- D- methionine
Smiles: CSCC[C@H](C(=O)O)NC(=O)Nc1cccc(c1)Br

STK577369
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)NCc1cccs1)C

STK848786
Synonyms: methyl4- {[5- (2- hydroxy- 4- methoxyphenyl)- 3- methyl- 1H- pyrazol- 4- yl]oxy}benzoate
Smiles: COc1ccc(c(c1)O)c1[nH]nc(c1Oc1ccc(cc1)C(=O)OC)C

STK577371
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 8- [(dimethylammonio)methyl]- 4- oxo- 4H- chromen- 7- olate
Smiles: C[NH+](Cc1c([O-])ccc2c1occ(c2=O)c1nc2c(s1)cccc2)C

STK577372
Synonyms: N,N- bis(2- methoxyethyl)- 1- (3- methoxypropyl)- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)N(CCOC)CCOC

STK577373
Synonyms: N- methyl- N- [1- (thiophen- 2- yl)[1,2,4]triazolo[4,3- a]quinoxalin- 4- yl]benzenesulfonamide
Smiles: CN(S(=O)(=O)c1ccccc1)c1nc2ccccc2n2c1nnc2c1cccs1

STK577374
Synonyms: 2- {[(2Z)- 4- hydroxy- 1,3- thiazol- 2(5H)- ylidene]amino}- 2- oxoethyldiethylcarbamodithioate
Smiles: CCN(C(=S)SCC(=O)/N=C/1\SCC(=N1)O)CC

STK577376
Synonyms: N- {2- hydroxy- 1- [2- (5- methoxy- 1H- indol- 3- yl)ethyl]- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl}benzamide
Smiles: COc1ccc2c(c1)c(CCN1C(=NC(C1=O)(NC(=O)c1ccccc1)C(F)(F)F)O)c[nH]2

STK848788
Synonyms: azepan- 1- yl[2- (1,3- benzothiazol- 2- yl)pyridin- 3- yl]methanone
Smiles: O=C(c1cccnc1c1nc2c(s1)cccc2)N1CCCCCC1

STK577377
Synonyms: 2- methyl- 9- {4- [2- (naphthalen- 1- yloxy)ethyl]piperazin- 1- yl}- 3- phenyl- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazoline
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2N2CCN(CC2)CCOc2cccc3c2cccc3)CCCC1

STK577380
Synonyms: 6- amino- 4- hydroxy- 1- (2- methoxybenzyl)pyrimidin- 2(1H)- one
Smiles: COc1ccccc1Cn1c(N)cc(nc1=O)O

STK577382
Synonyms: N- [(2Z)- 3- (2,5- dimethoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]tetrahydrofuran- 2- carboxamide
Smiles: COc1ccc(c(c1)N1/C(=N/C(=O)C2CCCO2)/SC2C1CS(=O)(=O)C2)OC

STK577385
Synonyms: N,N,3,6,6- pentamethyl- 4- oxo- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: CN(C(=O)c1oc2c(c1C)C(=O)CC(C2)(C)C)C

STK848789
Synonyms: 8- (3- chloro- 2- methylphenyl)- 1,3,6,7- tetramethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Clc1cccc(c1C)n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)C

STK848790
Synonyms: 8,10- dimethyl- 4- (2- methyl- 1H- imidazol- 1- yl)- 2- propylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidine
Smiles: CCCc1nc2c3c(C)cc(nc3nn2c(c1)n1ccnc1C)C

STK577390
Synonyms: 7- hydroxy- 5- (4- methoxyphenyl)- 2- methyl- 5,6- dihydropyrido[2,3- d]pyrimidin- 4(3H)- one
Smiles: COc1ccc(cc1)C1CC(=Nc2c1c(=O)[nH]c(n2)C)O

STK848791
Synonyms: 1- [4- (propan- 2- yl)phenyl]- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CC(c1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cccc1)C

STK848792
Synonyms: N- (furan- 2- ylmethyl)- 1- (3- methoxypropyl)- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCc1ccco1

STK577391
Synonyms: N- [(4- fluorophenyl)carbamoyl]- L- leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)Nc1ccc(cc1)F)C

STK577393
Synonyms: 4- chloro- N- (1- methyl- 2- {2- [4- (pyridin- 2- yl)piperazin- 1- yl]ethyl}- 1H- benzimidazol- 5- yl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)nc(n2C)CCN1CCN(CC1)c1ccccn1

STK577395
Synonyms: 4- acetyl- N- [4- (furan- 2- yl)butan- 2- yl]- N- methylbenzenesulfonamide
Smiles: CC(N(S(=O)(=O)c1ccc(cc1)C(=O)C)C)CCc1ccco1

STK848796
Synonyms: 4- chloro- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (tetrahydrofuran- 2- ylmethyl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)CC1CCCO1

STK577408
Synonyms: N- [2- (4- chlorophenyl)- 5- hydroxy[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 2- phenylbutanamide
Smiles: CCC(c1ccccc1)C(=O)Nc1cc(O)nc2n1nc(n2)c1ccc(cc1)Cl

STK848797
Synonyms: 2- [(2,5- dimethoxyphenyl)amino]- 4H- pyrido[3,2- e][1,3]thiazin- 4- one
Smiles: COc1ccc(cc1Nc1nc(=O)c2c(s1)nccc2)OC

STK577415
Synonyms: 4- amino- N- (5- chloro- 2- methoxyphenyl)- 3- methyl- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: COc1ccc(cc1NC(=O)c1sc(=S)n(c1N)C)Cl

STK577417
Synonyms: N- (3- chloro- 2- methylphenyl)- 5- (2- hydroxy- 4,6- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1cc(C)c(c(c1)O)c1[nH]nc(c1)C(=O)Nc1cccc(c1C)Cl

STK848799
Synonyms: 5- (propan- 2- yl)- N'- [(E)- pyridin- 2- ylmethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)C(C)C)N/N=C/c1ccccn1

STK577421
Synonyms: 2- methyl- 7- [4- (2- methylphenyl)piperazin- 1- yl]- 3- phenyl- 5- propylpyrazolo[1,5- a]pyrimidine
Smiles: CCCc1cc(N2CCN(CC2)c2ccccc2C)n2c(n1)c(c1ccccc1)c(n2)C

STK848802
Synonyms: 5- tert- butyl- 3- (4- chlorophenyl)- N- (pyridin- 2- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(cc2NCc1ccccn1)C(C)(C)C

STK577427
Synonyms: 5- amino- 1- (3- chloro- 2- methylphenyl)- 4- (4- hydroxyquinazolin- 2- yl)- 1,2- dihydro- 3H- pyrrol- 3- one
Smiles: O=C1CN(C(=C1c1nc(O)c2c(n1)cccc2)N)c1cccc(c1C)Cl

STK848803
Synonyms: 5- [2- (3,4- dimethoxyphenyl)ethyl]- 3- (2- hydroxyphenyl)- 4- (4- methoxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)C1N(CCc2ccc(c(c2)OC)OC)C(=O)c2c1c([nH]n2)c1ccccc1O

STK848804
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- (4- methoxybenzyl)- 6,8- dimethyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: COc1ccc(cc1)CN(C(=O)c1cc(=O)c2c(o1)c(C)cc(c2)C)C1CCS(=O)(=O)C1

STK577430
Synonyms: 2,10- dimethyl- 3- phenylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: Cc1nc2c(c(=O)n1c1ccccc1)c(=O)c1c(n2C)cccc1

STK577432
Synonyms: N- (1- hydroxybutan- 2- yl)- 5- methyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CCC(NC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2)CO

STK577437
Synonyms: 5- [1- {[(4- chlorophenyl)amino]acetyl}- 5- (4- methoxyphenyl)pyrazolidin- 3- ylidene]- 1,3- dimethylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1)C1CC(=C2C(=O)N(C)C(=O)N(C2=O)C)NN1C(=O)CNc1ccc(cc1)Cl

STK577439
Synonyms: methyl6- (3- chlorophenyl)- 3- methyl- 4- oxo- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxylate
Smiles: COC(=O)c1oc2c(c1C)C(=O)CC(C2)c1cccc(c1)Cl

STK577441
Synonyms: 2- (benzylsulfanyl)- 6- (2- hydroxyethyl)- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: OCCc1c(C)nc2n(c1O)nc(n2)SCc1ccccc1

STK577444
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (4- chlorophenyl)- 5- (2- hydroxyethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1ccc(cc1)Cl)c([nH]n2)c1cc(Cl)c(cc1O)C

STK577448
Synonyms: 2- ({5- [(1S)- 1- amino- 3- methylbutyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)- N- (3- chloro- 2- methylphenyl)acetamide
Smiles: N[C@H](c1nnc(o1)SCC(=O)Nc1cccc(c1C)Cl)CC(C)C

STK577451
Synonyms: 1- (2- {[(2E)- 6- methoxy- 1,3- benzothiazol- 2(3H)- ylidene]amino}- 2- oxoethyl)piperidine- 4- carboxamide
Smiles: COc1ccc2c(c1)s/c(=N/C(=O)CN1CCC(CC1)C(=O)N)/[nH]2

STK577457
Synonyms: 7- (1H- benzimidazol- 1- yl)- 3- phenyl- 5- propylpyrazolo[1,5- a]pyrimidine
Smiles: CCCc1nc2c(cnn2c(c1)n1cnc2c1cccc2)c1ccccc1

STK848806
Synonyms: N- (4- phenyl- 1,2,5- oxadiazol- 3- yl)- 2,3- dihydro- 1,4- benzodioxine- 2- carboxamide
Smiles: O=C(C1COc2c(O1)cccc2)Nc1nonc1c1ccccc1

STK577459
Synonyms: 2,3- diphenyl- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazolin- 9- ol
Smiles: Oc1c2CCCCc2nc2n1nc(c2c1ccccc1)c1ccccc1

STK577461
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 5- (2- hydroxy- 4,5- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1cc(C)c(cc1O)C)NCc1ccc2c(c1)OCO2

STK577467
Synonyms: 6- hydroxy- 3- methyl- 8- [(4- methylbenzyl)amino]- 7- (2- methylprop- 2- en- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(=C)Cn1c(NCc2ccc(cc2)C)nc2c1c(O)nc(=O)n2C

STK577471
Synonyms: 5- tert- butyl- 3- phenyl- 7- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}pyrazolo[1,5- a]pyrimidine
Smiles: CC(c1cc(N2CCN(CC2)C/C=C/c2ccccc2)n2c(n1)c(cn2)c1ccccc1)(C)C

STK577480
Synonyms: N- [3- (ethylcarbamoyl)- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl]- 5- (2- hydroxy- 5- methylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: CCNC(=O)c1c(NC(=O)c2n[nH]c(c2)c2cc(C)ccc2O)sc2c1CCCC2

STK848808
Synonyms: 2,7- dimethyl- 1- phenyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1)C

STK577483
Synonyms: 5- [(3- methoxybenzyl)amino]- 2- (morpholin- 4- ium- 4- yl)benzoate
Smiles: COc1cccc(c1)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK577489
Synonyms: tert- butyl(3S)- 3- {[2- (1,3- benzodioxol- 5- ylamino)- 2- oxoethyl]carbamoyl}- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: O=C(Nc1ccc2c(c1)OCO2)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK577490
Synonyms: 3- (3- chlorophenyl)- 2- [(2- hydroxyethyl)amino]- 7- methyl- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: OCCNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C

STK848809
Synonyms: 2- (4- chlorophenyl)- N- [4- (3,4- dimethoxyphenyl)- 1,2,5- oxadiazol- 3- yl]acetamide
Smiles: COc1cc(ccc1OC)c1nonc1NC(=O)Cc1ccc(cc1)Cl

STK848810
Synonyms: 3- (2- chlorophenyl)- 5- methyl- N- [2- (morpholin- 4- yl)ethyl]pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1cc(NCCN2CCOCC2)n2c(n1)c(cn2)c1ccccc1Cl

STK577494
Synonyms: N- [3- (1H- imidazol- 1- yl)propyl]- 5,6- dimethyl- 7- (pyridin- 2- yl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1c(C)n(c2c1c(NCCCn1cncc1)ncn2)c1ccccn1

STK577496
Synonyms: 3- {(5E)- 5- [(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}propanoicacid
Smiles: OC(=O)CCN1C(=S)S/C(=C/c2ccc3c(c2)CC(O3)C)/C1=O

STK577498
Synonyms: 3- (1,3- benzodioxol- 5- ylmethyl)- 2',6'- dihydroxy- 8- nitro- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidin]- 4'- one
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-]

STK577500
Synonyms: 7- benzyl- 9- (trifluoromethyl)thieno[2,3- b:4,5- b']dipyridine- 2,4- diol
Smiles: Oc1cc(O)c2c(n1)c1c(s2)nc(cc1C(F)(F)F)Cc1ccccc1

STK577503
Synonyms: N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (pyridin- 3- ylmethyl)pyridine- 3- carboxamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1cccnc1)Cc1cccnc1

STK577506
Synonyms: 4- methoxy- N- [3- (2- oxopyrrolidin- 1- yl)propyl]- 1H- indole- 2- carboxamide
Smiles: COc1cccc2c1cc([nH]2)C(=O)NCCCN1CCCC1=O

STK577507
Synonyms: N- (4- {[5- tert- butyl- 3- (2- chlorophenyl)- 2- methylpyrazolo[1,5- a]pyrimidin- 7- yl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1cc(nc2n1nc(c2c1ccccc1Cl)C)C(C)(C)C

STK577508
Synonyms: 2'- hydroxy- 1',9- dimethyl- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[benzo[g]pyrido[1,2- a][1,8]naphthyridine- 5,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: Cc1ccc2c(c1)cc1c(n2)N2CCCCC2C2(C1)C(=O)N=C(N(C2=O)C)O

STK848812
Synonyms: 5- tert- butyl- 3- (4- methylphenyl)pyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1ccc(cc1)c1cnn2c1nc(cc2O)C(C)(C)C

STK577516
Synonyms: 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- (3- hydroxypropyl)- 4- (3- methoxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1cccc(c1)OC)c([nH]n2)c1cc(C)cc(c1O)C

STK577517
Synonyms: 2- [(5Z)- 5- benzylidene- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- [2- (1H- indol- 3- yl)ethyl]acetamide
Smiles: O=C(CN1C(=O)S/C(=C\c2ccccc2)/C1=O)NCCc1c[nH]c2c1cccc2

STK577518
Synonyms: 2- [2- amino- 5- (3,4- dimethoxyphenyl)pyrimidin- 4- yl]- 5- [(2,6- dichlorobenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cnc(nc1c1ccc(cc1O)OCc1c(Cl)cccc1Cl)N

STK577520
Synonyms: 2',6'- dihydroxy- 4- methyl- 3,4- dihydro- 1H,4'H- spiro[benzo[f]quinoline- 2,5'- pyrimidin]- 4'- one
Smiles: OC1=NC(=O)C2(C(=N1)O)CN(C)c1c(C2)c2ccccc2cc1

STK577523
Synonyms: 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- (2- ethoxyphenyl)hexanamide
Smiles: CCOc1ccccc1NC(=O)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK577524
Synonyms: cyclopropyl(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)C1CC1

STK577528
Synonyms: N- [2- (dimethylamino)ethyl]- 2,3- dihydro- 1H- cyclopenta[b]quinoline- 9- carboxamide
Smiles: CN(CCNC(=O)c1c2CCCc2nc2c1cccc2)C

STK577529
Synonyms: 2- {[4- (furan- 2- ylmethyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK577531
Synonyms: tert- butyl(3S)- 3- {[(2S)- 1- (1,3- benzodioxol- 5- ylamino)- 1- oxopropan- 2- yl]carbamoyl}- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK848818
Synonyms: N- (2,5- difluorophenyl)quinoxaline- 6- carboxamide
Smiles: Fc1ccc(c(c1)NC(=O)c1ccc2c(c1)nccn2)F

STK848819
Synonyms: N- (3- chloro- 4- fluorophenyl)- 2- hydroxy- 7,7- dimethyl- 5- oxo- 3,4,5,6,7,8- hexahydroquinoline- 4- carboxamide
Smiles: OC1=NC2=C(C(C1)C(=O)Nc1ccc(c(c1)Cl)F)C(=O)CC(C2)(C)C

STK577534
Synonyms: 4- {[4- (diphenylmethyl)piperazin- 1- yl]methyl}- 5,7- dimethyl- 2H- chromen- 2- one
Smiles: Cc1cc(C)c2c(c1)oc(=O)cc2CN1CCN(CC1)C(c1ccccc1)c1ccccc1

STK848821
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(5- fluoro- 2- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(F)ccc1C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK577537
Synonyms: 5- (3- ethoxyphenyl)- 4- {[(E)- furan- 2- ylmethylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccco1

STK577539
Synonyms: ethyl4- [(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)acetyl]- 2,5- dimethyl- 1H- pyrrole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)[nH]c(c1C(=O)CN1CCc2c(C1)cc(c(c2)OC)OC)C

STK577541
Synonyms: (5Z)- 5- (3,4- dimethoxybenzylidene)- 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- methyl- 2,6- dioxo- 1,2,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CC1=C(C)/C(=C/c2ccc(c(c2)OC)OC)/C(=O)N(C1=O)C1CCS(=O)(=O)C1

STK577542
Synonyms: 5- ({3- [(5E)- 5- (4- fluorobenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)C(=O)O)O)CCN1C(=O)S/C(=C/c2ccc(cc2)F)/C1=O

STK848822
Synonyms: (4Z)- 4- {[(4- chlorophenyl)amino]methylidene}- 5- methyl- 2- phenyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: Clc1ccc(cc1)N/C=C\1/C(=NN(C1=O)c1ccccc1)C

STK577545
Synonyms: N- [2- (furan- 2- yl)- 5- hydroxy[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 3- methylbutanamide
Smiles: CC(CC(=O)Nc1cc(O)nc2n1nc(n2)c1ccco1)C

STK577550
Synonyms: 7- (4- benzylpiperazin- 1- yl)- 3- (2- methoxyphenyl)- 5- methylpyrazolo[1,5- a]pyrimidine
Smiles: COc1ccccc1c1cnn2c1nc(C)cc2N1CCN(CC1)Cc1ccccc1

STK577554
Synonyms: N- [(2Z)- 3- (4- acetylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 3- cyclopentylpropanamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccc(cc1)C(=O)C)CS(=O)(=O)C2)CCC1CCCC1

STK848824
Synonyms: 2- ethyl- 5- methyl- N- [3- (morpholin- 4- yl)propyl]- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CCc1nn2c(c1c1ccccc1)nc(cc2NCCCN1CCOCC1)C

STK577555
Synonyms: 2,4- dichloro- N- [5- hydroxy- 2- (2- phenylethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)Nc1cc(O)nc2n1nc(n2)CCc1ccccc1

STK577559
Synonyms: 2- [4- (4- bromophenyl)- 3- (trifluoromethyl)- 1H- pyrazol- 5- yl]- 5- [(4- nitrobenzyl)oxy]phenol
Smiles: Brc1ccc(cc1)c1c([nH]nc1C(F)(F)F)c1ccc(cc1O)OCc1ccc(cc1)[N+](=O)[O-]

STK577560
Synonyms: 1- (4- bromophenyl)- 5,7- dimethyl- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Brc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)c(C)cc(c1)C

STK577561
Synonyms: ethyl4- ({4- [(cyclohexyloxy)carbonyl]phenyl}amino)- 6- methylquinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)C(=O)OC1CCCCC1)cc(cc2)C

STK577562
Synonyms: 5- tert- butyl- N- (3,4- dimethylphenyl)- 2- methyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1nn2c(c1c1ccccc1)nc(cc2Nc1ccc(c(c1)C)C)C(C)(C)C

STK577565
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 5- (3- hydroxypropyl)- 4- phenyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1ccccc1)c([nH]n2)c1cc(Cl)c(cc1O)C

STK577569
Synonyms: trans- 4- ({[(2R)- 2- (2,4- dioxo- 1,4- dihydroquinazolin- 3(2H)- yl)- 3- (1H- indol- 3- yl)propanoyl]amino}methyl)cyclohexanecarboxylicacid
Smiles: OC(=O)[C@@H]1CC[C@H](CC1)CNC(=O)[C@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1c[nH]c2c1cccc2

STK577571
Synonyms: 5- bromo- 2- [(2E)- 2- (5- cyano- 6- hydroxy- 4- methyl- 2- oxopyridin- 3(2H)- ylidene)hydrazinyl]benzoicacid
Smiles: N#CC1=C(C)/C(=N\Nc2ccc(cc2C(=O)O)Br)/C(=O)N=C1O

STK848827
Synonyms: N- (5- chloro- 2- methoxyphenyl)- 2- {[3- cyano- 4- (3,4- dimethoxyphenyl)- 6- hydroxy- 4,5- dihydropyridin- 2- yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)ccc2OC)N=C(CC1c1ccc(c(c1)OC)OC)O

STK848828
Synonyms: 3- phenyl- 5- (propan- 2- yl)- N- (pyridin- 2- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CC(c1cc(NCc2ccccn2)n2c(n1)c(cn2)c1ccccc1)C

STK577577
Synonyms: N,5- dimethyl- 4- (2- methyl- 1H- indol- 3- yl)- 1,3- thiazol- 2- amine
Smiles: CNc1sc(c(n1)c1c(C)[nH]c2c1cccc2)C

STK577582
Synonyms: N- (3- bromobenzyl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)thiophene- 2- carboxamide
Smiles: Brc1cccc(c1)CN(C(=O)c1cccs1)C1CCS(=O)(=O)C1

STK577587
Synonyms: 5- [(2,4- dichlorobenzyl)oxy]- 2- [4- (3,4- dimethoxyphenyl)- 1H- pyrazol- 3- yl]phenol
Smiles: COc1cc(ccc1OC)c1c[nH]nc1c1ccc(cc1O)OCc1ccc(cc1Cl)Cl

STK848835
Synonyms: 6- ethyl- 4- oxo- N- (4- sulfamoylphenyl)- 4H- chromene- 2- carboxamide
Smiles: CCc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc1ccc(cc1)S(=O)(=O)N

STK577589
Synonyms: 3- [(2,5- dimethylbenzyl)sulfanyl]- 5- (2- methoxyphenyl)- 4- phenyl- 4H- 1,2,4- triazole
Smiles: COc1ccccc1c1nnc(n1c1ccccc1)SCc1cc(C)ccc1C

STK577590
Synonyms: 2- (9- methyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)aniline
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1ccccc1N

STK577591
Synonyms: N- (5- chloro- 2- cyanophenyl)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1cc(Cl)ccc1C#N

STK577592
Synonyms: N- [(3- hydroxyquinoxalin- 1(2H)- yl)carbonyl]glycine
Smiles: OC(=O)CNC(=O)N1CC(=Nc2c1cccc2)O

STK577593
Synonyms: methylN- [(4- sulfamoylbenzyl)carbamoyl]- L- phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccc(cc1)S(=O)(=O)N

STK577596
Synonyms: (2- hydroxy- 6,6- dimethyl- 4- oxo- 5,8- dihydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 3(6H)- yl)aceticacid
Smiles: OC(=O)Cn1c(O)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK848840
Synonyms: 2- [(2Z)- 1,3- benzoxazol- 2(3H)- ylideneamino]- 4- methyl- N- phenylpyrimidine- 5- carboxamide
Smiles: O=C(c1cnc(nc1C)/N=c/1\oc2c([nH]1)cccc2)Nc1ccccc1

STK848841
Synonyms: 2- {[(5E)- 5- (acetylimino)- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N- (4- ethylphenyl)acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1n[nH]/c(=N\C(=O)C)/s1

STK577598
Synonyms: 5- (2,5- dimethoxyphenyl)- N'- [(E)- thiophen- 2- ylmethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: COc1ccc(cc1c1[nH]nc(c1)C(=O)N/N=C/c1cccs1)OC

STK577600
Synonyms: 8,9,10,11- tetrahydro- 7H- cyclohepta[5',6']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine- 2,4- diol
Smiles: Oc1nc(O)c2c(n1)c1cc3CCCCCc3nc1s2

STK577601
Synonyms: N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- propylbenzenesulfonamide
Smiles: CCCN(S(=O)(=O)c1ccccc1)Cc1cc2ccc(cc2[nH]c1=O)C

STK577602
Synonyms: 2,4- dihydroxy- 6,7- dimethoxy- N- (4- methylbenzyl)quinoline- 3- carboxamide
Smiles: COc1cc2nc(O)c(c(c2cc1OC)O)C(=O)NCc1ccc(cc1)C

STK577604
Synonyms: N- ({4- [(4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)methyl]cyclohexyl}carbonyl)- beta- alanine
Smiles: OC(=O)CCNC(=O)C1CCC(CC1)Cn1nnc2c(c1=O)cccc2

STK848843
Synonyms: 1- (3- methoxypropyl)- N,9- dimethyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NC

STK577610
Synonyms: 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- 1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethanone
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)C12CC3CC(C2)CC(C1)C3

STK577611
Synonyms: (2E)- 2- [(1- methyl- 1H- pyrrol- 2- yl)methylidene]- N'- nitrohydrazinecarboximidamide
Smiles: N/C(=N\[N+](=O)[O-])/N/N=C/c1cccn1C

STK577615
Synonyms: 5- [2- (3,4- dimethoxyphenyl)ethyl]- 4- (4- ethylphenyl)- 3- (2- hydroxy- 3,5- dimethylphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCc1ccc(cc1)C1N(CCc2ccc(c(c2)OC)OC)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C

STK848845
Synonyms: 8- (furan- 2- ylmethyl)- 1,7- dimethyl- 3- (2- methylpropyl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)Cc1ccco1)C)C

STK577620
Synonyms: N- [(5- chloro- 1- methyl- 1H- indol- 2- yl)carbonyl]- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)c1cc2c(n1C)ccc(c2)Cl

STK577621
Synonyms: 5- ({[(5Z)- 5- (4- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]acetyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(CN1C(=S)S/C(=C\c2ccc(cc2)Cl)/C1=O)Nc1ccc(c(c1)C(=O)O)O

STK848847
Synonyms: 6,8- dimethyl- 4- oxo- N- [2- (phenylcarbonyl)- 1- benzofuran- 3- yl]- 4H- chromene- 2- carboxamide
Smiles: Cc1cc(C)c2c(c1)c(=O)cc(o2)C(=O)Nc1c(oc2c1cccc2)C(=O)c1ccccc1

STK577629
Synonyms: N- [5- (2- methylpropyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- yl]ethane- 1,2- diamine
Smiles: NCCNc1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C

STK577630
Synonyms: (5Z)- 2- (2- chlorophenyl)- 5- (3,4- dimethoxybenzylidene)- 3- methyl- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: COc1cc(ccc1OC)/C=C/1\N=C(N(C1=O)C)c1ccccc1Cl

STK577631
Synonyms: N- [2- (4- chlorophenyl)- 4- (4- methoxyphenyl)- 6- methyl- 5- oxo- 2,5- dihydropyridazin- 3- yl]butanamide
Smiles: CCCC(=O)Nc1c(c2ccc(cc2)OC)c(=O)c(nn1c1ccc(cc1)Cl)C

STK577632
Synonyms: 1- (3- ethoxy- 4- hydroxyphenyl)- 2- (furan- 2- ylmethyl)- 5,7- dimethyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cc(ccc1O)C1N(Cc2ccco2)C(=O)c2c1c(=O)c1c(o2)c(C)cc(c1)C

STK577634
Synonyms: (2Z)- 6- [(2- fluorobenzyl)oxy]- 2- [(2- methyl- 2H- chromen- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: CC1Oc2ccccc2C=C1/C=C/1\Oc2c(C1=O)ccc(c2)OCc1ccccc1F

STK848849
Synonyms: methyl{7- hydroxy- 5- methyl- 2- [(thiophen- 2- ylmethyl)amino][1,2,4]triazolo[1,5- a]pyrimidin- 6- yl}acetate
Smiles: COC(=O)Cc1c(C)nc2n(c1O)nc(n2)NCc1cccs1

STK577638
Synonyms: (3E)- 3- {2- oxo- 2- [4- (propan- 2- yloxy)phenyl]ethylidene}- 1,3- dihydro- 2H- indol- 2- one
Smiles: CC(Oc1ccc(cc1)C(=O)/C=C\1/C(=O)Nc2c1cccc2)C

STK848850
Synonyms: (4Z)- 6- (1- benzofuran- 2- yl)- 4- [(4- fluorophenyl)imino]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Fc1ccc(cc1)/N=c/1\nc(N)nc([nH]1)c1cc2c(o1)cccc2

STK577644
Synonyms: 4- {[4- (diphenylmethyl)piperazin- 1- ium- 1- yl]methyl}- 7- methyl- 2- oxo- 2H- chromen- 5- olate
Smiles: Cc1cc([O-])c2c(c1)oc(=O)cc2C[NH+]1CCN(CC1)C(c1ccccc1)c1ccccc1

STK577645
Synonyms: 8- (3- ethoxyphenyl)- 9- (5- methyl- 1,2- oxazol- 3- yl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: CCOc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK577646
Synonyms: 4- {[(E)- (3- methoxyphenyl)methylidene]amino}- 5- (pyridin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccccn1

STK577648
Synonyms: 4- hydroxy- 5- iodopyrimidin- 2(1H)- one
Smiles: Oc1nc(=O)[nH]cc1I

STK577649
Synonyms: 3- [(2,6- dichlorobenzyl)sulfanyl]- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazol- 4- amine
Smiles: Nn1c(nnc1c1[nH]nc2c1CCC2)SCc1c(Cl)cccc1Cl

STK577652
Synonyms: (2R)- ({N- [(3- hydroxyquinoxalin- 1(2H)- yl)carbonyl]glycyl}amino)(phenyl)ethanoicacid
Smiles: OC1=Nc2ccccc2N(C1)C(=O)NCC(=O)N[C@H](c1ccccc1)C(=O)O

STK577657
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (4- ethoxy- 3- methoxyphenyl)- 5- (3- hydroxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1ccc(c(c1)OC)OCC)c([nH]n2)c1cc(Cl)c(cc1O)C

STK577659
Synonyms: (5Z)- 3- hexyl- 5- ({3- [2- methyl- 4- (propan- 2- yloxy)phenyl]- 1- phenyl- 1H- pyrazol- 4- yl}methylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2C)OC(C)C)c2ccccc2)/C1=O

STK577660
Synonyms: 6- (2- chlorobenzyl)- 7,9- dimethyl- 6H- indolo[2,3- b]quinoxaline
Smiles: Cc1cc(C)c2c(c1)c1nc3ccccc3nc1n2Cc1ccccc1Cl

STK577663
Synonyms: 8- (4- benzylpiperidin- 1- yl)- 7- ethyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCC(CC1)Cc1ccccc1

STK848854
Synonyms: 5- [2- (3,4- dimethoxyphenyl)ethyl]- 3- (2- hydroxyphenyl)- 4- phenyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1OC)CCN1C(=O)c2c(C1c1ccccc1)c([nH]n2)c1ccccc1O

STK848855
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 5- (pyridin- 4- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1ccc2c(c1)OCO2)c1ccncc1

STK577668
Synonyms: (1- hydroxy- 4,5,6,7- tetrahydro- 1H- benzimidazol- 2- yl)(4- phenoxyphenyl)methanone
Smiles: O=C(c1nc2c(n1O)CCCC2)c1ccc(cc1)Oc1ccccc1

STK848857
Synonyms: 4- [4- (2- ethoxyphenoxy)- 1H- pyrazol- 3- yl]benzene- 1,3- diol
Smiles: CCOc1ccccc1Oc1c[nH]nc1c1ccc(cc1O)O

STK577674
Synonyms: 4- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 7- methyl- 2- oxo- 2H- chromen- 6- olate
Smiles: OCCN1CC[NH+](CC1)Cc1cc(=O)oc2c1cc([O-])c(c2)C

STK577679
Synonyms: 5,6- dimethyl- 7- (4- methylphenyl)- N- (1,3- thiazol- 2- yl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1ccc(cc1)n1c(C)c(c2c1ncnc2Nc1nccs1)C

STK577683
Synonyms: 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- (2- hydroxyethyl)- 4- (3,4,5- trimethoxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1cc(OC)c(c(c1)OC)OC)c([nH]n2)c1cc(C)cc(c1O)C

STK577686
Synonyms: 12- (2- methoxyphenyl)- 2,9,9- trimethyl- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccccc1C1C2=C(Oc3c1c1nc(nn1cn3)C)CC(CC2=O)(C)C

STK848859
Synonyms: N- [1- (2- fluorophenyl)- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]- 3,4,5- trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC1(N=C(N(C1=O)c1ccccc1F)O)C(F)(F)F

STK577690
Synonyms: 3- (2,4- dimethoxyphenyl)- 11- methyl- 3,4- dihydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: COc1ccc(c(c1)OC)C1CC(=C2C(=Nc3ccccc3N=C2C)C1)O

STK577691
Synonyms: N- (3- bromobenzyl)- 5- chloro- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 3- methyl- 1- benzofuran- 2- carboxamide
Smiles: Clc1ccc2c(c1)c(C)c(o2)C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Br

STK577693
Synonyms: 5- [(3,4- dichlorobenzyl)oxy]- 2- [5- (3,4- dimethoxyphenyl)pyrimidin- 4- yl]phenol
Smiles: COc1cc(ccc1OC)c1cncnc1c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl

STK848864
Synonyms: 2- methyl- 7- (morpholin- 4- yl)- 3- phenyl- 5- (propan- 2- yl)pyrazolo[1,5- a]pyrimidine
Smiles: CC(c1cc(N2CCOCC2)n2c(n1)c(c1ccccc1)c(n2)C)C

STK577694
Synonyms: 2- amino- 4- (furan- 2- yl)- 5- hydroxy- 7- methyl- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccco1)c(O)nc(c2)C

STK577697
Synonyms: 3- [3- (dimethylamino)propyl]- 5- (furan- 2- yl)- 4- imino- 3,5- dihydro- 4H- chromeno[2,3- d]pyrimidin- 8- ol
Smiles: CN(CCCn1cnc2c(c1=N)C(c1ccco1)c1c(O2)cc(cc1)O)C

STK848865
Synonyms: 5- [2- (3,4- dimethoxyphenyl)ethyl]- 3- (2- hydroxyphenyl)- 4- (3- hydroxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1OC)CCN1C(=O)c2c(C1c1cccc(c1)O)c([nH]n2)c1ccccc1O

STK577699
Synonyms: 1- (3- chlorophenyl)- 6- propyl- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2c1cccc(c1)Cl)S

STK577700
Synonyms: 2- (1- methoxypropan- 2- yl)- 2,3- dihydro- 1H- isoindol- 1- imine
Smiles: COCC(N1Cc2c(C1=N)cccc2)C

STK577701
Synonyms: N- [3- (4- methylphenyl)- 1,2- oxazol- 5- yl]furan- 2- carboxamide
Smiles: Cc1ccc(cc1)c1noc(c1)NC(=O)c1ccco1

STK577704
Synonyms: (5- fluoro- 1H- indol- 2- yl)[4- (furan- 2- ylcarbonyl)piperazin- 1- yl]methanone
Smiles: Fc1ccc2c(c1)cc([nH]2)C(=O)N1CCN(CC1)C(=O)c1ccco1

STK848867
Synonyms: 4- (4- chlorophenyl)- 3- (2- hydroxyphenyl)- 5- propyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCCN1C(=O)c2c(C1c1ccc(cc1)Cl)c([nH]n2)c1ccccc1O

STK577706
Synonyms: methylN- {(E)- [4- hydroxy- 1- (3- methoxyphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=NC(=O)N(C1=O)c1cccc(c1)OC)O

STK577708
Synonyms: 6- benzyl- 5- methyl- 2- (phenoxymethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1nc2nc(nn2c(c1Cc1ccccc1)O)COc1ccccc1

STK848868
Synonyms: 3- (3,4- dimethoxyphenyl)- 2,5- dimethyl- N- (pyridin- 2- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: COc1ccc(cc1OC)c1c(C)nn2c1nc(C)cc2NCc1ccccn1

STK577711
Synonyms: N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)- 2,1,3- benzoxadiazole- 4- sulfonamide
Smiles: CC(CN(S(=O)(=O)c1cccc2c1non2)Cc1cc2ccc(cc2[nH]c1=O)C)C

STK577714
Synonyms: 3- benzyl- 2- {[2- (2- hydroxyethoxy)ethyl]amino}- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: OCCOCCNc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCCCC3

STK577715
Synonyms: 4- (3- ethoxyphenyl)- 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- (pyridin- 3- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCOc1cccc(c1)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C

STK848869
Synonyms: 2- [(4- phenyl- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 3- yl)methyl]phthalazin- 1(2H)- one
Smiles: S=c1[nH]nc(n1c1ccccc1)Cn1ncc2c(c1=O)cccc2

STK848870
Synonyms: 1- (3- methoxypropyl)- N- (2- methylphenyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)Nc1ccccc1C

STK848871
Synonyms: 3- (2,3- dihydro- 1,4- benzodioxin- 2- yl)- N- (2,4- dimethoxyphenyl)propanamide
Smiles: COc1cc(OC)ccc1NC(=O)CCC1COc2c(O1)cccc2

STK577719
Synonyms: 3- (4- methoxyphenyl)- 3,4- dihydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3ccccc3N=C2)C1)O

STK577720
Synonyms: 10- (5- chloro- 2- hydroxyphenyl)- 1,3- dimethyl- 5- phenyl- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: Clc1ccc(c(c1)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C)O

STK848872
Synonyms: ethyl2- amino- 1- [3- (diethylsulfamoyl)phenyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)S(=O)(=O)N(CC)CC

STK577732
Synonyms: 6- benzyl- 5- methyl- 2- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1nc2nc(nn2c(c1Cc1ccccc1)O)c1ccccc1

STK577734
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- {[(2- ethoxyphenyl)carbonyl]amino}- 6- methyl- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxamide
Smiles: CCOc1ccccc1C(=O)Nc1sc2c(c1C(=O)NC1CCS(=O)(=O)C1)CCC(C2)C

STK848876
Synonyms: 7- (morpholin- 4- yl)- 3- phenyl- 5- propylpyrazolo[1,5- a]pyrimidine
Smiles: CCCc1cc(N2CCOCC2)n2c(n1)c(cn2)c1ccccc1

STK848877
Synonyms: 3- (4- chlorophenyl)- 5- methyl- 7- [4- (2- methylphenyl)piperazin- 1- yl]pyrazolo[1,5- a]pyrimidine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)cc2N1CCN(CC1)c1ccccc1C

STK577738
Synonyms: 6- cyclohexyl- 1- (pyridin- 3- ylmethyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(S)n(c2c1CN(CN2)C1CCCCC1)Cc1cccnc1

STK577749
Synonyms: 2- hydroxy- N- (3- methoxyphenyl)- 5- oxo- 7- phenyl- 3,4,5,6,7,8- hexahydroquinoline- 4- carboxamide
Smiles: COc1cccc(c1)NC(=O)C1CC(=NC2=C1C(=O)CC(C2)c1ccccc1)O

STK577750
Synonyms: 8- bromo- 6- hydroxy- 3- methyl- 7- propyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCn1c(Br)nc2c1c(O)nc(=O)n2C

STK577751
Synonyms: N- ({3- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]phenyl}carbonyl)- L- alanine
Smiles: C[C@@H](C(=O)O)NC(=O)c1cccc(c1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK577755
Synonyms: 6- hydroxy- 7- [2- (4- methoxyphenyl)ethyl]- 3- methyl- 8- (pyrrolidin- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: COc1ccc(cc1)CCn1c(nc2c1c(O)nc(=O)n2C)N1CCCC1

STK577756
Synonyms: 4- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)- N- (pyridin- 3- yl)butanamide
Smiles: O=C(Nc1cccnc1)CCCn1nnc2c(c1=O)cccc2

STK577757
Synonyms: 5- [(4- chlorobenzyl)oxy]- 2- [4- (2- ethoxyphenoxy)- 1H- pyrazol- 3- yl]phenol
Smiles: CCOc1ccccc1Oc1c[nH]nc1c1ccc(cc1O)OCc1ccc(cc1)Cl

STK577760
Synonyms: 2- (1,3- benzoxazol- 2- ylamino)- 7,7- dimethyl- 4- (pyridin- 3- yl)- 4,6,7,8- tetrahydroquinazolin- 5- ol
Smiles: OC1=C2C(=NC(=NC2c2cccnc2)Nc2nc3c(o2)cccc3)CC(C1)(C)C

STK848879
Synonyms: 2- fluoro- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (tetrahydrofuran- 2- ylmethyl)benzamide
Smiles: Fc1ccccc1C(=O)N(Cc1cc2cccc(c2[nH]c1=O)C)CC1CCCO1

STK577764
Synonyms: 1,3- dimethyl- 5- [5- (naphthalen- 1- yl)pyrazolidin- 3- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1N(C)C(=O)C(=C2NNC(C2)c2cccc3c2cccc3)C(=O)N1C

STK577765
Synonyms: 1- [10- (furan- 2- yl)- 8- methyl- 2- (pyridin- 2- yl)- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: CC(=O)C1=C(C)Oc2c(C1c1ccco1)c1nc(nn1cn2)c1ccccn1

STK577771
Synonyms: (1'S,3R,3'S,7a'S)- 5''- chloro- 1'- (naphthalen- 2- ylcarbonyl)- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: Clc1ccc2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)cccc2

STK848881
Synonyms: 7- (2- chlorophenyl)- 2- (4- methoxyphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1ccccc1Cl

STK577778
Synonyms: 7- {(E)- [2- (5H- [1,2,4]triazino[5,6- b]indol- 3- yl)hydrazinylidene]methyl}[1,3]dioxolo[4,5- g]quinolin- 6(5H)- one
Smiles: O=c1[nH]c2cc3OCOc3cc2cc1/C=N/Nc1nnc2c(n1)[nH]c1c2cccc1

STK577784
Synonyms: 2- [5,7- bis(4- chlorophenyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]- 3a,4,7,7a- tetrahydro- 1H- isoindole- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)N1C(=O)C2C(C1=O)CC=CC2)c1ccc(cc1)Cl

STK848882
Synonyms: 3- (2- hydroxyphenyl)- 4- (3- methoxyphenyl)- 5- (tetrahydrofuran- 2- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1cccc(c1)C1N(CC2CCCO2)C(=O)c2c1c([nH]n2)c1ccccc1O

STK577789
Synonyms: 2- [5- hydroxy- 2- (phenoxymethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 1H- isoindole- 1,3(2H)- dione
Smiles: Oc1cc(N2C(=O)c3c(C2=O)cccc3)n2c(n1)nc(n2)COc1ccccc1

STK848883
Synonyms: 1- benzyl- N- (5- chloro- 2- methoxyphenyl)- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COc1ccc(cc1NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C)Cl

STK848884
Synonyms: 1- [7,9- dimethyl- 4- (thiophen- 2- yl)- 2,3,3a,9b- tetrahydrofuro[3,2- c]quinolin- 5(4H)- yl]ethanone
Smiles: Cc1cc(C)c2c(c1)N(C(=O)C)C(C1C2OCC1)c1cccs1

STK577790
Synonyms: ethyl2- (2- hydroxyphenyl)- 10- (4- methoxyphenyl)- 8- methyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 9- carboxylate
Smiles: CCOC(=O)C1=C(C)Oc2c(C1c1ccc(cc1)OC)c1nc(nn1cn2)c1ccccc1O

STK577791
Synonyms: 2,6- dihydroxy- 3- (prop- 2- en- 1- yl)- 5- {(2E)- 3- [2- (trifluoromethyl)phenyl]prop- 2- enoyl}pyrimidin- 4(3H)- one
Smiles: C=CCn1c(O)nc(c(c1=O)C(=O)/C=C/c1ccccc1C(F)(F)F)O

STK577792
Synonyms: 2,3- dihydro- 1H- indol- 1- yl(5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)methanone
Smiles: Cc1cc(C)n2c(n1)nc(n2)C(=O)N1CCc2c1cccc2

STK848888
Synonyms: 7- hydrazinyl- 3- (2- methoxyphenyl)- 2,5- dimethylpyrazolo[1,5- a]pyrimidine
Smiles: COc1ccccc1c1c(C)nn2c1nc(C)cc2NN

STK577795
Synonyms: 3- (2- chlorophenyl)- 6- hydroxy- 1',6'- dimethyl- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4(3H)- dione
Smiles: Cc1ccc2c(c1)CC1(CN2C)C(=NC(=O)N(C1=O)c1ccccc1Cl)O

STK577797
Synonyms: N- {[(3S)- 2- (tert- butoxycarbonyl)- 1,2,3,4- tetrahydroisoquinolin- 3- yl]carbonyl}- beta- alanine
Smiles: OC(=O)CCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK577798
Synonyms: (5Z)- 3- butyl- 5- ({3- [2- methyl- 4- (2- methylpropoxy)phenyl]- 1- phenyl- 1H- pyrazol- 4- yl}methylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2C)OCC(C)C)c2ccccc2)/C1=O

STK577800
Synonyms: 1- amino- 2- (dimethylamino)- 4- [(3- methoxyphenyl)amino]anthracene- 9,10- dione
Smiles: COc1cccc(c1)Nc1cc(N(C)C)c(c2c1C(=O)c1ccccc1C2=O)N

STK848890
Synonyms: 4- (4- fluorophenyl)- 3- (2- hydroxyphenyl)- 5- [2- (4- methoxyphenyl)ethyl]- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(cc1)F)c([nH]n2)c1ccccc1O

STK577801
Synonyms: N- (3- bromobenzyl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 3,5,6- trimethyl- 1- benzofuran- 2- carboxamide
Smiles: Brc1cccc(c1)CN(C(=O)c1oc2c(c1C)cc(c(c2)C)C)C1CCS(=O)(=O)C1

STK577805
Synonyms: 2- [7- (3,5- dimethylphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]- 5- methoxyphenol
Smiles: COc1ccc(c(c1)O)c1nnc2n1cnc1c2cnn1c1cc(C)cc(c1)C

STK577808
Synonyms: 3- (1H- indol- 3- yl)- N- [3- (1H- tetrazol- 1- yl)phenyl]propanamide
Smiles: O=C(Nc1cccc(c1)n1cnnn1)CCc1c[nH]c2c1cccc2

STK577810
Synonyms: 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- (3- hydroxypropyl)- 4- (4- methylphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1ccc(cc1)C)c([nH]n2)c1cc(C)cc(c1O)C

STK848892
Synonyms: N- ethyl- 1- (3- methoxypropyl)- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCC

STK577812
Synonyms: 6- chloro- 3- (4- methoxyphenyl)- 2- methyl- 5- propylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCCc1nc2c(c3ccc(cc3)OC)c(nn2c(c1Cl)O)C

STK577814
Synonyms: 2- (2,3- dichlorophenyl)- 4- [(4- methylphenyl)carbonyl]hexahydropyrrolo[3,4- a]pyrrolizine- 1,3(2H,4H)- dione
Smiles: Cc1ccc(cc1)C(=O)C1N2CCCC2C2C1C(=O)N(C2=O)c1cccc(c1Cl)Cl

STK577815
Synonyms: 2- chloro- 5- [3- (pyridin- 4- yl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]benzoicacid
Smiles: OC(=O)c1cc(ccc1Cl)n1c(=S)[nH]nc1c1ccncc1

STK577816
Synonyms: 3- (5- fluoro- 2- hydroxyphenyl)- 4- (2- fluorophenyl)- 5- [2- (4- methoxyphenyl)ethyl]- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccccc1F)c([nH]n2)c1cc(F)ccc1O

STK848893
Synonyms: 3- amino- 8,9- dimethoxy- 1- phenyl- 1H- [1,3,5]triazino[1,2- a]quinazolin- 6- ol
Smiles: COc1cc2c(cc1OC)c(O)nc1=NC(=NC(n21)c1ccccc1)N

STK577818
Synonyms: N'- (8,10- dimethyl- 2- propylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidin- 4- yl)- N,N- dimethylethane- 1,2- diamine
Smiles: CCCc1cc(NCCN(C)C)n2c(n1)c1c(C)cc(nc1n2)C

STK577819
Synonyms: 2- (4- fluorophenyl)- 1- (3,5,6,7- tetrahydro- 1'H- spiro[imidazo[4,5- c]pyridine- 4,4'- piperidin]- 1'- yl)ethanone
Smiles: Fc1ccc(cc1)CC(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK577822
Synonyms: 3- [(E)- phenyl(2- phenylhydrazinylidene)methyl]quinoxalin- 2- ol
Smiles: Oc1nc2ccccc2nc1/C(=N/Nc1ccccc1)/c1ccccc1

STK577825
Synonyms: 2- [(5- tert- butyl- 2- methyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- yl)sulfanyl]- N- (2- nitrophenyl)acetamide
Smiles: O=C(Nc1ccccc1[N+](=O)[O-])CSc1cc(nc2n1nc(c2c1ccccc1)C)C(C)(C)C

STK577830
Synonyms: 6,8- dibromo- N- [3- (dimethylamino)propyl]- 2,4- dihydroxyquinoline- 3- carboxamide
Smiles: CN(CCCNC(=O)c1c(O)nc2c(c1O)cc(cc2Br)Br)C

STK577831
Synonyms: 12- (4- methoxyphenyl)- 2- phenyl- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccc(cc1)C1C2=C(CCCC2=O)Oc2c1c1nc(nn1cn2)c1ccccc1

STK577838
Synonyms: 1- tert- butyl4- (2- oxo- 2H- chromen- 7- yl)piperidine- 1,4- dicarboxylate
Smiles: O=C(C1CCN(CC1)C(=O)OC(C)(C)C)Oc1ccc2c(c1)oc(=O)cc2

STK577842
Synonyms: 3- (decyloxy)tetrahydrothiophene1,1- dioxide
Smiles: CCCCCCCCCCOC1CCS(=O)(=O)C1

STK577847
Synonyms: 1- (4- chlorobenzyl)- 8- (cyclopentylamino)- 3,7- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)NC1CCCC1

STK577850
Synonyms: N- (3- bromobenzyl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Br

STK577853
Synonyms: 3- (4- ethoxyphenyl)- 5- [(2E)- 3- (4- ethoxyphenyl)prop- 2- enoyl]- 2,6- dihydroxypyrimidin- 4(3H)- one
Smiles: CCOc1ccc(cc1)/C=C/C(=O)c1c(O)nc(n(c1=O)c1ccc(cc1)OCC)O

STK577860
Synonyms: 8- (butan- 2- yl)- 4- hydroxy- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: CCC(n1c(C)cn2c1nc1c2c(O)nc(=O)n1C)C

STK577865
Synonyms: 5- [(2- chlorobenzyl)oxy]- 2- [5- (3,4- dimethoxyphenyl)pyrimidin- 4- yl]phenol
Smiles: COc1cc(ccc1OC)c1cncnc1c1ccc(cc1O)OCc1ccccc1Cl

STK848897
Synonyms: 7- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 2- methyl- 3- phenyl- 5- propylpyrazolo[1,5- a]pyrimidine
Smiles: CCCc1nc2c(c3ccccc3)c(nn2c(c1)n1nc(cc1C)C)C

STK848898
Synonyms: 5- methyl- 3- (4- methylphenyl)- N- [2- (morpholin- 4- yl)ethyl]pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1cc(NCCN2CCOCC2)n2c(n1)c(cn2)c1ccc(cc1)C

STK577868
Synonyms: 1- (4- fluorophenyl)- 3- [4- hydroxy- 6- (4- methoxyphenyl)pyrimidin- 2- yl]guanidine
Smiles: COc1ccc(cc1)c1nc(nc(c1)O)NC(=N)Nc1ccc(cc1)F

STK848901
Synonyms: (6E)- 6- {[5- (4- fluorophenyl)furan- 2- yl]methylidene}- 7- imino- 2- methyl- 6,7- dihydro- 5H- [1,2]oxazolo[2,3- a]pyrimidin- 5- one
Smiles: Fc1ccc(cc1)c1ccc(o1)/C=C\1/C(=O)N=c2n(C1=N)oc(c2)C

STK577873
Synonyms: 2- (2,4- dimethoxyphenyl)- N- [3- (1H- tetrazol- 1- yl)phenyl]acetamide
Smiles: COc1ccc(c(c1)OC)CC(=O)Nc1cccc(c1)n1cnnn1

STK577875
Synonyms: N- (cyclooctylcarbamoyl)- L- leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)NC1CCCCCCC1)C

STK577876
Synonyms: tert- butyl(3S)- 3- ({(2S)- 1- [(4- methylbenzyl)amino]- 1- oxopropan- 2- yl}carbamoyl)- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: O=C([C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C)NCc1ccc(cc1)C

STK577877
Synonyms: N- [(3,5- dimethylphenyl)carbamoyl]- L- valine
Smiles: O=C(N[C@H](C(=O)O)C(C)C)Nc1cc(C)cc(c1)C

STK577883
Synonyms: 4- [3- (propan- 2- yl)phenoxy][1,2,4]triazolo[4,3- a]quinoxaline
Smiles: CC(c1cccc(c1)Oc1nc2ccccc2n2c1nnc2)C

STK577884
Synonyms: N- benzyl- 5- (2- hydroxy- 5- methylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(c(c1)c1[nH]nc(c1)C(=O)NCc1ccccc1)O

STK577886
Synonyms: 2- [8- imino- 7- (2- methoxyphenyl)- 7H- benzo[7,8]chromeno[2,3- d]pyrimidin- 9(8H)- yl]- N,N- dimethylethanamine
Smiles: COc1ccccc1C1c2c(ncn(c2=N)CCN(C)C)Oc2c1ccc1c2cccc1

STK848904
Synonyms: 2- [3- (4- chlorophenyl)- 1H- pyrazol- 5- yl]- 4- methylphenol
Smiles: Clc1ccc(cc1)c1n[nH]c(c1)c1cc(C)ccc1O

STK577893
Synonyms: tert- butyl[(1S)- 1- (6- {[2- (dimethylamino)- 2- oxoethyl]sulfanyl}[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl)- 2- phenylethyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc2n1nc(s2)SCC(=O)N(C)C)Cc1ccccc1

STK848905
Synonyms: 4- oxo- N- {3- [(2- phenylethyl)carbamoyl]- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl}- 4H- chromene- 2- carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)Nc1sc2c(c1C(=O)NCCc1ccccc1)CCC2

STK577896
Synonyms: 3- [(E)- (2- benzylhydrazinylidene)methyl]- 2- chloro- 6- methylquinoline
Smiles: Cc1ccc2c(c1)cc(c(n2)Cl)/C=N/NCc1ccccc1

STK577898
Synonyms: 1- (4- ethylphenyl)- 5,7- dimethyl- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)c(C)cc(c1)C

STK577900
Synonyms: ethyl[7- hydroxy- 3- phenyl- 2- (trifluoromethyl)pyrazolo[1,5- a]pyrimidin- 5- yl]acetate
Smiles: CCOC(=O)Cc1cc(O)n2c(n1)c(c1ccccc1)c(n2)C(F)(F)F

STK848906
Synonyms: 6- methyl- 4- oxo- N- [4- (pyrimidin- 2- ylsulfamoyl)phenyl]- 4H- chromene- 2- carboxamide
Smiles: Cc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1

STK848907
Synonyms: 3- (2- methoxyethyl)- 1,7- dimethyl- 8- (2- methylphenyl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccccc1C)C

STK577906
Synonyms: 2- [(7,7- dimethyl- 2- phenyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl)sulfanyl]- N,N- diethylethanamine
Smiles: CCN(CCSc1nc(nc2c1COC(C2)(C)C)c1ccccc1)CC

STK848908
Synonyms: 1- benzyl- 2- (piperidin- 1- ylcarbonyl)pyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=c1c2cc(n(c2nc2n1cccc2)Cc1ccccc1)C(=O)N1CCCCC1

STK577914
Synonyms: 6- chloro- 4- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 5,7- dimethyl- 2H- chromen- 2- one
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1cc(=O)oc2c1c(C)c(c(c2)C)Cl

STK577920
Synonyms: 4- (3,4- diethoxyphenyl)- 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- (pyridin- 3- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCOc1cc(ccc1OCC)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C

STK577926
Synonyms: 2- [4- (4- chlorophenyl)- 3- methyl- 1,2- oxazol- 5- yl]- 5- [(2- fluorobenzyl)oxy]phenol
Smiles: Clc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1ccccc1F

STK577927
Synonyms: N- [4- (dimethylamino)phenyl]- 5- fluoro- 1H- indole- 2- carboxamide
Smiles: Fc1ccc2c(c1)cc([nH]2)C(=O)Nc1ccc(cc1)N(C)C

STK577932
Synonyms: 6,8- dibromo- 2,4- dihydroxy- N- (pyridin- 3- ylmethyl)quinoline- 3- carboxamide
Smiles: Brc1cc(Br)c2c(c1)c(O)c(c(n2)O)C(=O)NCc1cccnc1

STK577934
Synonyms: 5- hydroxy- N- {[(6- methyl- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl)oxy]acetyl}tryptophan
Smiles: O=C(NC(C(=O)O)Cc1c[nH]c2c1cc(O)cc2)COc1ccc2c(c1C)oc(=O)c1c2CCC1

STK577938
Synonyms: 4- {[(3- methoxyphenyl)ammonio]methyl}- 2- oxo- 7- phenyl- 2H- chromen- 6- olate
Smiles: COc1cccc(c1)[NH2+]Cc1cc(=O)oc2c1cc([O-])c(c2)c1ccccc1

STK848914
Synonyms: N- (2,4- dimethoxyphenyl)- 4,7,7- trimethyl- 3- oxobicyclo[2.2.1]heptane- 1- carboxamide
Smiles: COc1cc(OC)ccc1NC(=O)C12CCC(C2(C)C)(C(=O)C1)C

STK577939
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 5- [2- (3,4- dimethoxyphenyl)ethyl]- 4- phenyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1cc(CCN2C(=O)c3c(C2c2ccccc2)c([nH]n3)c2cc(Cl)c(cc2O)C)ccc1OC

STK577940
Synonyms: (5Z)- 2- [(4- fluorophenyl)amino]- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]- 1,3- thiazol- 4(5H)- one
Smiles: Fc1ccc(cc1)NC1=NC(=O)/C(=C/C=C/c2ccco2)/S1

STK577942
Synonyms: 4,5- dichloro- 2- methyl- 1- (2- phenoxyethyl)- 1H- imidazole
Smiles: Clc1nc(n(c1Cl)CCOc1ccccc1)C

STK577944
Synonyms: 8- benzyl- 5- (3- methylpiperidin- 1- yl)- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidine
Smiles: CC1CCCN(C1)c1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1

STK577945
Synonyms: 3- (4- chlorophenyl)- 11- methyl- 3,4- dihydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: Clc1ccc(cc1)C1CC(=C2C(=Nc3ccccc3N=C2C)C1)O

STK577948
Synonyms: 4- hydroxy- 2H- pyrido[1,2- a]pyrimidin- 2- one
Smiles: O=c1cc(O)n2c(n1)cccc2

STK577956
Synonyms: 3- (2- {(E)- [1- (3- chlorophenyl)- 2- hydroxy- 5- oxo- 1,5- dihydro- 4H- imidazol- 4- ylidene]methyl}- 1H- pyrrol- 1- yl)benzoicacid
Smiles: Clc1cccc(c1)N1C(=N/C(=C/c2cccn2c2cccc(c2)C(=O)O)/C1=O)O

STK577958
Synonyms: 3- nitro- N- [4- oxo- 3- (3,4,5- trimethoxyphenyl)- 4H- chromen- 2- yl]benzamide
Smiles: COc1cc(cc(c1OC)OC)c1c(NC(=O)c2cccc(c2)[N+](=O)[O-])oc2c(c1=O)cccc2

STK577960
Synonyms: 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- N- [(3- methylphenyl)sulfonyl]- N- propylacetamide
Smiles: CCCN(S(=O)(=O)c1cccc(c1)C)C(=O)CN1CCc2c(C1)cc(c(c2)OC)OC

STK577961
Synonyms: propan- 2- ylN- [(1- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 2- yl)carbonyl]glycinate
Smiles: CC(OC(=O)CNC(=O)c1cc2c(n1C)nc1n(c2=O)cccc1)C

STK848915
Synonyms: N- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 1- (3- methylphenyl)- 4- oxo- 1,4- dihydropyridazine- 3- carboxamide
Smiles: N#Cc1c(NC(=O)c2nn(ccc2=O)c2cccc(c2)C)sc2c1CCCC2

STK577964
Synonyms: ethyl4- [(5- methoxy- 3- methyl- 1H- indol- 2- yl)carbonyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)c1[nH]c2c(c1C)cc(cc2)OC

STK577966
Synonyms: N- [2- (4- chlorophenyl)ethyl]- 2- (5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)acetamide
Smiles: O=C(Cn1c2ccccc2c2c1c(=O)n1CCSc1n2)NCCc1ccc(cc1)Cl

STK577968
Synonyms: 5- methoxy- 3- methyl- N- [3- (morpholin- 4- yl)propyl]- 1H- indole- 2- carboxamide
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)NCCCN1CCOCC1

STK848917
Synonyms: 1- benzyl- 7- methyl- 2- (pyrrolidin- 1- ylcarbonyl)pyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 4(1H)- one
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)n(c(c1)C(=O)N1CCCC1)Cc1ccccc1

STK577969
Synonyms: 4- bromo- N'- [(E)- (2- hydroxy- 7- methoxyquinolin- 3- yl)methylidene]benzohydrazide
Smiles: COc1ccc2c(c1)nc(c(c2)/C=N/NC(=O)c1ccc(cc1)Br)O

STK577972
Synonyms: 3- [(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)carbonyl]- 9H- thioxanthen- 9- one10,10- dioxide
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc2c(c1)S(=O)(=O)c1c(C2=O)cccc1

STK577975
Synonyms: 1- benzyl- 9- methyl- N- [2- (morpholin- 4- yl)ethyl]- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: O=C(c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C)NCCN1CCOCC1

STK577977
Synonyms: 2- (4- bromophenyl)- N- [2- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)ethyl]acetamide
Smiles: O=C(Cc1ccc(cc1)Br)NCCc1nnc2n1cccc2

STK577981
Synonyms: 12- (furan- 2- yl)- 2- (pyridin- 4- yl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: O=C1CCCC2=C1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1ccncc1

STK577984
Synonyms: 1- [2- (3,4- dimethoxybenzyl)- 10- (furan- 2- yl)- 8- methyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: COc1cc(ccc1OC)Cc1nn2c(n1)c1c(nc2)OC(=C(C1c1ccco1)C(=O)C)C

STK577985
Synonyms: 4- amino- 3- (4- methoxyphenyl)- N- (naphthalen- 1- yl)- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: COc1ccc(cc1)n1c(=S)sc(c1N)C(=O)Nc1cccc2c1cccc2

STK577988
Synonyms: 2- methylpropyl(2Z)- 2- {[(6- chloro- 7- methyl- 4- oxo- 4H- chromen- 2- yl)carbonyl]imino}- 4- methyl- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: CC(COC(=O)c1s/c(=N\C(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)/[nH]c1C)C

STK848920
Synonyms: N- [(2E)- 5- {[2- (2,3- dihydro- 1H- indol- 1- yl)- 2- oxoethyl]sulfanyl}- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: CC(=O)/N=c/1\[nH]nc(s1)SCC(=O)N1CCc2c1cccc2

STK848921
Synonyms: N- [4- (4- methylphenyl)- 1,2,5- oxadiazol- 3- yl]- 2- phenylacetamide
Smiles: O=C(Nc1nonc1c1ccc(cc1)C)Cc1ccccc1

STK577993
Synonyms: 2- (4- methoxyphenyl)- 6,7- dihydro- 5H- cyclopenta[d][1,2,4]triazolo[1,5- a]pyrimidin- 8- ol
Smiles: COc1ccc(cc1)c1nc2n(n1)c(O)c1c(n2)CCC1

STK577995
Synonyms: (5Z)- 5- [5- (3,4- dimethoxyphenyl)pyrazolidin- 3- ylidene]- 6- hydroxy- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C\2/NNC(C2)c2ccc(c(c2)OC)OC)/C1=O)O

STK577997
Synonyms: 7- chloro- 1- (4- hydroxy- 3- methoxyphenyl)- 6- methyl- 2- [3- (propan- 2- yloxy)propyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(ccc1O)C1N(CCCOC(C)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK577998
Synonyms: 4- chloro- 5- [(2E)- 2- (pyridin- 3- ylmethylidene)hydrazinyl]pyridazin- 3- ol
Smiles: Clc1c(N/N=C/c2cccnc2)cnnc1O

STK577999
Synonyms: 3- (4- chlorophenyl)- 7- (3,4- dichlorophenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Clc1ccc(cc1)c1nnc2n1cnc1c2cnn1c1ccc(c(c1)Cl)Cl

STK578000
Synonyms: 4- {[(E)- (4- chloro- 3- nitrophenyl)methylidene]amino}- 5- cyclohexyl- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: [O-][N+](=O)c1cc(ccc1Cl)/C=N/n1c(=S)[nH]nc1C1CCCCC1

STK578001
Synonyms: (2R)- {[(2,4- dioxo- 1,4- dihydroquinazolin- 3(2H)- yl)acetyl]amino}(phenyl)ethanoicacid
Smiles: O=C(Cn1c(=O)[nH]c2c(c1=O)cccc2)N[C@H](c1ccccc1)C(=O)O

STK578003
Synonyms: 2- (3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (furan- 2- ylmethyl)- 6- phenylpyrimidin- 4- amine
Smiles: Cc1nn(c(c1)C)c1nc(NCc2ccco2)cc(n1)c1ccccc1

STK578005
Synonyms: N- ({4- [(5- methyl- 1,2- oxazol- 3- yl)sulfamoyl]phenyl}carbamoyl)- L- alanine
Smiles: O=C(N[C@H](C(=O)O)C)Nc1ccc(cc1)S(=O)(=O)Nc1noc(c1)C

STK578011
Synonyms: 2- (4- fluorophenyl)- 8,9- dimethoxy- 5,6- dihydropyrrolo[2,1- a]isoquinoline
Smiles: COc1cc2c(cc1OC)CCn1c2cc(c1)c1ccc(cc1)F

STK848924
Synonyms: 2- amino- 5- (2,4- dimethoxyphenyl)- 4- hydroxy- 5,8- dihydropyrido[2,3- d]pyrimidin- 7(6H)- one
Smiles: COc1ccc(c(c1)OC)C1CC(=O)Nc2c1c(O)nc(n2)N

STK578022
Synonyms: 9- (4- methoxyphenyl)- 6- (2- methylphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1C

STK578023
Synonyms: 5- (2- hydroxy- 4,5- dimethylphenyl)- N- [4- (pyrimidin- 2- ylsulfamoyl)phenyl]- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1cc(C)c(cc1O)C)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1

STK848925
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 5- methyl- 3- (4- methylphenyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: COc1cc(CCNc2cc(C)nc3n2ncc3c2ccc(cc2)C)ccc1OC

STK578027
Synonyms: (3aR,6aS)- 3- (4- chlorophenyl)- 5- [3- (trifluoromethyl)phenyl]- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Clc1ccc(cc1)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F

STK578032
Synonyms: (6- fluoro- 2- methylquinolin- 4- yl)[4- (pyrimidin- 2- yl)piperazin- 1- yl]methanone
Smiles: Fc1ccc2c(c1)c(cc(n2)C)C(=O)N1CCN(CC1)c1ncccn1

STK848926
Synonyms: 1- (4- ethoxyphenyl)- 4- oxo- N- [3- (trifluoromethyl)phenyl]- 1,4- dihydropyridazine- 3- carboxamide
Smiles: CCOc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1cccc(c1)C(F)(F)F

STK848927
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 4- hydroxy- 3,6,6- trimethyl- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O=C(c1oc2c(c1C)C(O)CC(C2)(C)C)NCc1ccc2c(c1)OCO2

STK578040
Synonyms: N- (4- methoxyphenyl)- 1,7- dimethyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1cc2c(n1C)nc1n(c2=O)cc(cc1)C

STK848928
Synonyms: 8- (2,4- dimethoxyphenyl)- 3- (4- fluorophenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1OC)OC)c1ccc(cc1)F

STK578048
Synonyms: 2- chloro- N- [(2Z)- 3- (2- methoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: ClCC(=O)/N=C/1\SC2C(N1c1ccccc1OC)CS(=O)(=O)C2

STK578051
Synonyms: 2- [4- (3,4- dimethoxyphenyl)- 1H- pyrazol- 3- yl]- 5- [(4- ethenylbenzyl)oxy]phenol
Smiles: C=Cc1ccc(cc1)COc1ccc(c(c1)O)c1n[nH]cc1c1ccc(c(c1)OC)OC

STK578052
Synonyms: (1R,2S)- 2- ({1- [(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl]- 3,4- dihydroisoquinolin- 2(1H)- yl}carbonyl)cyclohexanecarboxylicacid
Smiles: OC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCc2c(C1CN1C(=O)c3c(C1=O)cccc3)cccc2

STK578059
Synonyms: 5- (5- chloro- 2- hydroxyphenyl)- N- [2- (3,4- dimethoxyphenyl)ethyl]- 1H- pyrazole- 3- carboxamide
Smiles: COc1cc(CCNC(=O)c2n[nH]c(c2)c2cc(Cl)ccc2O)ccc1OC

STK578064
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 5- hydroxy- 2- (methylsulfanyl)- 4,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccc2c(c1)OCO2

STK578067
Synonyms: 3- (3,4- dimethoxyphenyl)- 2,5- dimethyl- 7- [4- (2- methylprop- 2- en- 1- yl)piperazin- 1- yl]pyrazolo[1,5- a]pyrimidine
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)cc2N1CCN(CC1)CC(=C)C

STK578069
Synonyms: (5E)- 5- {[5- (3- chlorophenyl)furan- 2- yl]methylidene}- 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- methyl- 2,6- dioxo- 1,2,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CC1=C(C)/C(=C\c2ccc(o2)c2cccc(c2)Cl)/C(=O)N(C1=O)C1CCS(=O)(=O)C1

STK578070
Synonyms: 4- chloro- N- [(2- hydroxyquinolin- 4- yl)methyl]- N- (3- methylphenyl)benzamide
Smiles: Cc1cccc(c1)N(C(=O)c1ccc(cc1)Cl)Cc1cc(O)nc2c1cccc2

STK578075
Synonyms: N- [(4- sulfamoylphenyl)carbamoyl]- L- phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)Nc1ccc(cc1)S(=O)(=O)N

STK578077
Synonyms: 3- [(6- bromoquinolin- 8- yl)amino]- 2- benzofuran- 1(3H)- one
Smiles: Brc1cc(NC2OC(=O)c3c2cccc3)c2c(c1)cccn2

STK578078
Synonyms: methylN- (cyclopropylcarbamoyl)- L- phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)NC1CC1

STK848940
Synonyms: N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 2- (2,4- dioxo- 1,3- thiazolidin- 5- yl)acetamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CC1SC(=O)NC1=O

STK578092
Synonyms: N~2~- {[1- (4- methoxyphenyl)- 5- oxopyrrolidin- 3- yl]carbonyl}- N- (tetrahydrofuran- 2- ylmethyl)- L- valinamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)NCC1CCCO1)C(C)C

STK578099
Synonyms: 5- (2- chlorophenyl)- 4- (2- methoxyethyl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: COCCn1c(S)nnc1c1ccccc1Cl

STK578101
Synonyms: (4Z)- 4- [(3- methylphenyl)imino]- 6- [(4- methylpiperazin- 1- yl)methyl]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: CN1CCN(CC1)Cc1nc(N)n/c(=N\c2cccc(c2)C)/[nH]1

STK578102
Synonyms: 2- cyclopropyl- 1- [2- (2- methoxyphenoxy)ethyl]- 1H- benzimidazole
Smiles: COc1ccccc1OCCn1c(nc2c1cccc2)C1CC1

STK848942
Synonyms: 4- (3- chlorophenyl)- 3- (2- hydroxyphenyl)- 5- (3- hydroxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1cccc(c1)Cl)c([nH]n2)c1ccccc1O

STK578108
Synonyms: 7- (4- chlorophenyl)- 2,7- dihydro- 3H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine- 3- thione
Smiles: Clc1ccc(cc1)n1ncc2c1ncn1c2n[nH]c1=S

STK578110
Synonyms: 5- (2- hydroxy- 5- methylphenyl)- N- (5- propyl- 1,3,4- thiadiazol- 2- yl)- 1H- pyrazole- 3- carboxamide
Smiles: CCCc1nnc(s1)NC(=O)c1n[nH]c(c1)c1cc(C)ccc1O

STK578112
Synonyms: N- (4- fluorophenyl)- 4,5,6- trimethoxy- 1H- indole- 2- carboxamide
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)Nc1ccc(cc1)F

STK578114
Synonyms: 8- (4- chlorophenyl)- 10- methyl- 11- phenyl- 2- (pyridin- 2- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccc(cc1)n1nc(c2c1Oc1ncn3c(c1C2c1ccccc1)nc(n3)c1ccccn1)C

STK578115
Synonyms: N- ({5- [(2- ethylpiperidin- 1- yl)methyl]furan- 2- yl}methyl)- 3- methyl- 2- oxo- 2,3- dihydro- 1,3- benzoxazole- 6- sulfonamide
Smiles: CCC1CCCCN1Cc1ccc(o1)CNS(=O)(=O)c1ccc2c(c1)oc(=O)n2C

STK578117
Synonyms: (5E)- 5- ({[2- (piperazin- 1- yl)ethyl]amino}methylidene)- 2- sulfanyl- 1- [3- (trifluoromethyl)phenyl]pyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/NCCN1CCNCC1)c1cccc(c1)C(F)(F)F

STK578118
Synonyms: N- (3- bromobenzyl)- 3- chloro- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- methoxybenzamide
Smiles: COc1ccc(cc1Cl)C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Br

STK578119
Synonyms: methylN- {[2- (4- fluorophenyl)ethyl]carbamoyl}- L- methioninate
Smiles: COC(=O)[C@@H](NC(=O)NCCc1ccc(cc1)F)CCSC

STK578121
Synonyms: 4- [(2E)- 2- {[5- (3- nitrophenyl)furan- 2- yl]methylidene}hydrazinyl]- 5- phenylthieno[2,3- d]pyrimidine
Smiles: [O-][N+](=O)c1cccc(c1)c1ccc(o1)/C=N/Nc1ncnc2c1c(cs2)c1ccccc1

STK848943
Synonyms: N- (3- chlorophenyl)- 1- (3- methoxypropyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)Nc1cccc(c1)Cl

STK848947
Synonyms: N- [3- (1H- imidazol- 1- yl)propyl]- 5,6- dimethyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1nc2c(cnn2c(c1C)NCCCn1cncc1)c1ccccc1

STK578127
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (2,3- dimethylphenyl)- 5- ethyl- 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: CCc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1C)C

STK578131
Synonyms: 2- methyl- 9- (4- methylpiperazin- 1- yl)- 3- phenyl- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazoline
Smiles: CN1CCN(CC1)c1c2CCCCc2nc2n1nc(c2c1ccccc1)C

STK578134
Synonyms: 4- [(3a'S,6a'R)- 5- fluoro- 3'- (4- hydroxybenzyl)- 2,4',6'- trioxo- 1,2,2',3',3a',4',6',6a'- octahydro- 5'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 5'- yl]benzamide
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(cc1)C(=O)N)Cc1ccc(cc1)O)C(=O)N2

STK578136
Synonyms: 2- {[4- amino- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,5- dichlorophenyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK578138
Synonyms: (5E)- 5- {[3- (4- chlorophenyl)- 1- phenyl- 1H- pyrazol- 4- yl]methylidene}- 4- hydroxy- 1,3- thiazole- 2(5H)- thione
Smiles: Clc1ccc(cc1)c1nn(cc1/C=C\1/SC(=S)N=C1O)c1ccccc1

STK578144
Synonyms: 9- [4- (2,4- dimethylbenzyl)piperazin- 1- yl]- 2- methyl- 3- phenyl- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazoline
Smiles: Cc1ccc(c(c1)C)CN1CCN(CC1)c1c2CCCCc2nc2n1nc(c2c1ccccc1)C

STK578145
Synonyms: (5Z)- 3- (3- chloro- 4- fluorophenyl)- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\C=C\c2ccco2)/C(=O)N1c1ccc(c(c1)Cl)F

STK578147
Synonyms: (4E)- N- (furan- 2- ylmethyl)- 4- (hydroxyimino)- 3,6,6- trimethyl- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O/N=C/1\CC(C)(C)Cc2c1c(C)c(o2)C(=O)NCc1ccco1

STK578149
Synonyms: (5E)- 1- (2- fluorophenyl)- 5- [(morpholin- 4- ylamino)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/NN1CCOCC1)c1ccccc1F

STK578150
Synonyms: 8- {[4- (3- chlorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- pentyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK578151
Synonyms: 5- (2- hydroxy- 4,5- dimethylphenyl)- N- (4- methylbenzyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(cc1)CNC(=O)c1n[nH]c(c1)c1cc(C)c(cc1O)C

STK578152
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK578154
Synonyms: 6,7- dimethyl- 4- oxo- N- (pyridin- 3- yl)- 4H- chromene- 2- carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cc(c(c2)C)C)Nc1cccnc1

STK578155
Synonyms: 4- (3- ethoxy- 4- hydroxyphenyl)- 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- (pyridin- 3- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCOc1cc(ccc1O)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C

STK578156
Synonyms: 1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl(morpholin- 4- yl)methanone
Smiles: O=C(N1CCOCC1)N1CCC2(CC1)OCCO2

STK578159
Synonyms: N- [2- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)ethyl]thiophene- 2- carboxamide
Smiles: O=C(c1cccs1)NCCc1nnc2n1cccc2

STK578162
Synonyms: N,N- diethyl- N'- (8- methyl- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- yl)propane- 1,3- diamine
Smiles: CCN(CCCNc1nc2nnnn2c2c1c1CCN(Cc1s2)C)CC

STK578163
Synonyms: N- [benzyl(methyl)carbamoyl]- L- leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)N(Cc1ccccc1)C)C

STK848952
Synonyms: 3- (4- chlorophenyl)- N- [3- (1H- imidazol- 1- yl)propyl]- 5- methylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)cc2NCCCn1cncc1

STK578166
Synonyms: 6- chloro- N- (4- ethoxyphenyl)- 2- methylquinolin- 4- amine
Smiles: CCOc1ccc(cc1)Nc1cc(C)nc2c1cc(Cl)cc2

STK848953
Synonyms: 8- (5- bromo- 2- methoxyphenyl)- 3- (4- fluorophenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1cc(Br)ccc1OC)c1ccc(cc1)F

STK848954
Synonyms: 3- (2- hydroxyphenyl)- 5- (2- methoxyethyl)- 4- (4- methoxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COCCN1C(=O)c2c(C1c1ccc(cc1)OC)c([nH]n2)c1ccccc1O

STK848955
Synonyms: 4- (4- chlorophenyl)- 3- (2- hydroxyphenyl)- 5- (3- methoxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COCCCN1C(=O)c2c(C1c1ccc(cc1)Cl)c([nH]n2)c1ccccc1O

STK578168
Synonyms: N- [3- ({[6- chloro- 8- (trifluoromethyl)[1,2,4]triazolo[4,3- a]pyridin- 3- yl]methyl}amino)- 3- oxopropyl]benzamide
Smiles: O=C(NCc1nnc2n1cc(Cl)cc2C(F)(F)F)CCNC(=O)c1ccccc1

STK578169
Synonyms: 6- benzyl- 2- (benzylamino)- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1nc2nc(nn2c(c1Cc1ccccc1)O)NCc1ccccc1

STK578170
Synonyms: methyl4- (6,7- dimethyl- 3,9- dioxo- 1,2,3,9- tetrahydrochromeno[2,3- c]pyrrol- 1- yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1NC(=O)c2c1c(=O)c1c(o2)cc(c(c1)C)C

STK578173
Synonyms:
Smiles: CCC([C@@H](C(=O)NCc1ccco1)NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK578174
Synonyms: N- (3- chloro- 4- methylphenyl)- 5- (2- hydroxy- 4,5- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1cc(C)c(cc1O)C)Nc1ccc(c(c1)Cl)C

STK578181
Synonyms: 5- (5- chloro- 2- hydroxyphenyl)- N- [4- (difluoromethoxy)phenyl]- 1H- pyrazole- 3- carboxamide
Smiles: FC(Oc1ccc(cc1)NC(=O)c1n[nH]c(c1)c1cc(Cl)ccc1O)F

STK578184
Synonyms: 2- {[3- cyano- 4- (methoxymethyl)- 6- methylpyridin- 2- yl]sulfanyl}- N- [(2E)- 5- (trifluoromethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: COCc1cc(C)nc(c1C#N)SCC(=O)/N=c/1\[nH]nc(s1)C(F)(F)F

STK578185
Synonyms: 2- ethyl- 5,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CCc1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2

STK848956
Synonyms: N- (4- fluorophenyl)- 2- methyl- 3- phenyl- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazolin- 9- amine
Smiles: Fc1ccc(cc1)Nc1c2CCCCc2nc2n1nc(c2c1ccccc1)C

STK578188
Synonyms: 2,3- dihydro- 6H- [1,4]dioxino[2,3- f]indole- 7,8- dione
Smiles: O=C1C(=O)Nc2c1cc1OCCOc1c2

STK578190
Synonyms: 11- (furan- 2- yl)- 10- methyl- 2- [(4- methylphenoxy)methyl]- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1

STK578193
Synonyms: 3- (4- chlorophenyl)- 5- methyl- 7- [4- (2- methylprop- 2- en- 1- yl)piperazin- 1- yl]pyrazolo[1,5- a]pyrimidine
Smiles: CC(=C)CN1CCN(CC1)c1cc(C)nc2n1ncc2c1ccc(cc1)Cl

STK848958
Synonyms: 2- (3- hydroxy- 5- methyl- 4H- pyrazol- 4- yl)- N'- [(E)- (2- hydroxynaphthalen- 1- yl)methylidene]acetohydrazide
Smiles: O=C(CC1C(=NN=C1O)C)N/N=C/c1c(O)ccc2c1cccc2

STK578195
Synonyms: 1- (4- chlorophenyl)- 6- propyl- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2c1ccc(cc1)Cl)S

STK578201
Synonyms: 5- (2,6- dimethylmorpholin- 4- yl)- 2- [(E)- 2- phenylethenyl]- 1,3- oxazole- 4- carbonitrile
Smiles: N#Cc1nc(oc1N1CC(C)OC(C1)C)/C=C/c1ccccc1

STK848960
Synonyms: 3- (2- ethoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- ylfuran- 2- carboxylate
Smiles: CCOc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OC(=O)c1ccco1

STK848961
Synonyms: 3- (2- chlorophenyl)- 5- methyl- N- (pyridin- 2- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1cc(NCc2ccccn2)n2c(n1)c(cn2)c1ccccc1Cl

STK578212
Synonyms: 3- (2,3- dihydro- 1,4- benzodioxin- 2- yl)- N- (4- phenylbutan- 2- yl)propanamide
Smiles: CC(NC(=O)CCC1COc2c(O1)cccc2)CCc1ccccc1

STK578214
Synonyms: 4- ({N- [(5- chloro- 1- methyl- 1H- indol- 2- yl)carbonyl]- L- valyl}amino)butanoicacid
Smiles: OC(=O)CCCNC(=O)[C@H](C(C)C)NC(=O)c1cc2c(n1C)ccc(c2)Cl

STK578217
Synonyms: N- (2,4- dimethylphenyl)- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]methanesulfonamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)C)c1ccc(cc1C)C

STK578221
Synonyms: 6- chloro- 5,7- dimethyl- 4- [(4- phenylpiperazin- 1- yl)methyl]- 2H- chromen- 2- one
Smiles: O=c1cc(CN2CCN(CC2)c2ccccc2)c2c(o1)cc(c(c2C)Cl)C

STK578222
Synonyms: methyl2- [(4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)amino]- 4,5- dimethylthiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC2OC(=O)c3c2ccc(c3OC)OC)sc(c1C)C

STK848963
Synonyms: 3- (2- chlorophenyl)- N- [2- (3,4- dimethoxyphenyl)ethyl]- 5- methylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: COc1cc(CCNc2cc(C)nc3n2ncc3c2ccccc2Cl)ccc1OC

STK578226
Synonyms: 5- {2- amino- 3- [(2- methoxyethyl)carbamoyl]- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl}- 2- hydroxybenzoicacid
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)C(=O)O)O

STK578227
Synonyms: 4- bromo- N- [(3Z)- 6- methyl- 1- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]benzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)Br)/c2c1nc1ccc(cc1c2)C

STK578236
Synonyms: N- (3- bromobenzyl)- 2- (2,6- dimethylphenoxy)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)acetamide
Smiles: Brc1cccc(c1)CN(C1CCS(=O)(=O)C1)C(=O)COc1c(C)cccc1C

STK578237
Synonyms: 4- amino- 3- (4- methoxyphenyl)- N- (naphthalen- 2- yl)- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: COc1ccc(cc1)n1c(=S)sc(c1N)C(=O)Nc1ccc2c(c1)cccc2

STK578240
Synonyms: 4- (4- bromophenyl)- 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- (2- hydroxyethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1ccc(cc1)Br)c([nH]n2)c1cc(C)cc(c1O)C

STK578241
Synonyms: 5- (2- hydroxyphenyl)- N- {4- [(3- methylpiperidin- 1- yl)sulfonyl]phenyl}- 1H- pyrazole- 3- carboxamide
Smiles: CC1CCCN(C1)S(=O)(=O)c1ccc(cc1)NC(=O)c1n[nH]c(c1)c1ccccc1O

STK848970
Synonyms: 3- (4- chlorophenyl)- 6- ethyl- 5- methylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCc1c(C)nc2n(c1O)ncc2c1ccc(cc1)Cl

STK578248
Synonyms: 5- (2- hydroxy- 3,4- dimethylphenyl)- N- [4- (piperidin- 1- ylsulfonyl)phenyl]- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1O)C)C)Nc1ccc(cc1)S(=O)(=O)N1CCCCC1

STK578249
Synonyms: 9- methyl- 2- (thiophen- 2- yl)- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1cccs1

STK848974
Synonyms: 3- (3,4- dimethoxyphenyl)- 2,5- dimethyl- 7- (morpholin- 4- yl)pyrazolo[1,5- a]pyrimidine
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)cc2N1CCOCC1

STK578252
Synonyms: 2'- hydroxy- 1'- (2- phenylethyl)- 1,2,3,4,5,5a- hexahydro- 4'H,7H,8H- spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2- a]azepine- 6,5'- pyrimidine]- 4',6',8(1'H)- trione
Smiles: OC1=NC(=O)C2(C(=O)N1CCc1ccccc1)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2

STK578255
Synonyms: 3- (1H- benzimidazol- 2- yl)- N- (pyridin- 3- ylmethyl)propanamide
Smiles: O=C(CCc1nc2c([nH]1)cccc2)NCc1cccnc1

STK578257
Synonyms: 4- methoxy- N- [5- (4- methoxyphenyl)- 1,3- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydro- 6H- pyrrolo[3,4- d]pyrimidin- 6- yl]benzamide
Smiles: COc1ccc(cc1)C(=O)Nn1cc2c(c1c1ccc(cc1)OC)c(=O)n(c(=O)n2C)C

STK578258
Synonyms: (2Z)- 6- [2- (4- bromophenyl)- 2- oxoethoxy]- 2- [(2- methyl- 2H- chromen- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: Brc1ccc(cc1)C(=O)COc1ccc2c(c1)O/C(=C\C1=Cc3ccccc3OC1C)/C2=O

STK578263
Synonyms: N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 5- (2- hydroxy- 3,5- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1cc(C)c(c(c1)c1[nH]nc(c1)C(=O)Nc1c(=O)n(n(c1C)C)c1ccccc1)O

STK848975
Synonyms: 4- (4- chlorophenyl)- 5- [2- (3,4- dimethoxyphenyl)ethyl]- 3- (2- hydroxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1OC)CCN1C(=O)c2c(C1c1ccc(cc1)Cl)c([nH]n2)c1ccccc1O

STK578264
Synonyms: 5- (4- chlorophenyl)- 4- hydroxy- 2- (methylsulfanyl)- 5,8- dihydropyrido[2,3- d]pyrimidin- 7(6H)- one
Smiles: CSc1nc(O)c2c(n1)NC(=O)CC2c1ccc(cc1)Cl

STK578265
Synonyms: 2- (furan- 2- yl)- 12- (4- methoxyphenyl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccc(cc1)C1C2=C(CCCC2=O)Oc2c1c1nc(nn1cn2)c1ccco1

STK578268
Synonyms: 7- [(4- chlorobenzyl)oxy]- 3- (3,4- dimethoxyphenyl)- 2- methyl- 4H- chromen- 4- one
Smiles: COc1cc(ccc1OC)c1c(C)oc2c(c1=O)ccc(c2)OCc1ccc(cc1)Cl

STK578272
Synonyms: diethyl5- {[(6- chloro- 7- methyl- 4- oxo- 4H- chromen- 2- yl)carbonyl]amino}- 3- methylthiophene- 2,4- dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)sc(c1C)C(=O)OCC

STK848979
Synonyms: 2,5- dimethyl- 3- (4- methylphenyl)- N- (2- methylpropyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CC(CNc1cc(C)nc2n1nc(c2c1ccc(cc1)C)C)C

STK578274
Synonyms: 2- [2- amino- 5- (4- methoxyphenyl)- 6- methylpyrimidin- 4- yl]- 5- [(2- chloro- 6- fluorobenzyl)oxy]phenol
Smiles: COc1ccc(cc1)c1c(C)nc(nc1c1ccc(cc1O)OCc1c(F)cccc1Cl)N

STK578276
Synonyms: N- (4- fluorophenyl)- 2- methyl- 3- phenyl- 5- (propan- 2- yl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Fc1ccc(cc1)Nc1cc(nc2n1nc(c2c1ccccc1)C)C(C)C

STK578277
Synonyms: N- (1- benzylpiperidin- 4- yl)- 5- fluoro- 1H- indole- 2- carboxamide
Smiles: Fc1ccc2c(c1)cc([nH]2)C(=O)NC1CCN(CC1)Cc1ccccc1

STK578281
Synonyms: 5- tert- butyl- N- (2,4- dichlorobenzyl)- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Clc1ccc(c(c1)Cl)CNc1cc(nc2n1ncc2c1ccccc1)C(C)(C)C

STK848982
Synonyms: 7- chloro- 1- (2- fluorophenyl)- 2- methyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1F)C

STK578285
Synonyms: 3- (3- tert- butyl- 7- hydroxy- 1- methyl- 1H- pyrazolo[4,3- d]pyrimidin- 5- yl)- 4- ethoxy- N,N- bis(2- hydroxyethyl)benzenesulfonamide
Smiles: OCCN(S(=O)(=O)c1ccc(c(c1)c1nc(O)c2c(n1)c(nn2C)C(C)(C)C)OCC)CCO

STK578287
Synonyms: 6- chloro- N- [4- (dimethylamino)benzyl]- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 7- methyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)N(C)C)c1cc(=O)c2c(o1)cc(c(c2)Cl)C

STK578289
Synonyms: 3,4,5- trimethoxy- N- (2- methoxyethyl)- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: COCCN(C(=O)c1cc(OC)c(c(c1)OC)OC)Cc1cc2cc(C)ccc2[nH]c1=O

STK578291
Synonyms: N- (1H- benzimidazol- 2- yl)- 3- (4- oxoquinazolin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1nc2c([nH]1)cccc2)CCn1cnc2c(c1=O)cccc2

STK578305
Synonyms: 4- {[4- (2- methoxyphenyl)piperazin- 1- yl]methyl}- 6,8- dimethyl- 2H- chromen- 2- one
Smiles: COc1ccccc1N1CCN(CC1)Cc1cc(=O)oc2c1cc(C)cc2C

STK848984
Synonyms: 3- (3,4- dimethoxyphenyl)- 2,5- dimethyl- 7- (piperidin- 1- yl)pyrazolo[1,5- a]pyrimidine
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)cc2N1CCCCC1

STK578309
Synonyms: 3- [(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [(2R)- 1- hydroxy- 3- phenylpropan- 2- yl]propanamide
Smiles: OCC(Cc1ccccc1)NC(=O)CCN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK578310
Synonyms: 12- methyl- 2,3,4,12- tetrahydrobenzimidazo[2,1- b]quinazolin- 1- ol
Smiles: OC1=C2C(=Nc3n(C2C)c2ccccc2n3)CCC1

STK578311
Synonyms: 5- (5- chloro- 2- hydroxyphenyl)- N- [3- (trifluoromethyl)phenyl]- 1H- pyrazole- 3- carboxamide
Smiles: Clc1ccc(c(c1)c1[nH]nc(c1)C(=O)Nc1cccc(c1)C(F)(F)F)O

STK848986
Synonyms: methyl2- {[(E)- (3- methyl- 5- oxo- 1- phenyl- 1,5- dihydro- 4H- pyrazol- 4- ylidene)methyl]amino}benzoate
Smiles: COC(=O)c1ccccc1N/C=C/1\C(=NN(C1=O)c1ccccc1)C

STK578326
Synonyms: 3- {[(3,4- dimethoxyphenyl)sulfonyl]amino}- 5- methoxy- 1H- indole- 2- carboxylicacid
Smiles: COc1ccc2c(c1)c(NS(=O)(=O)c1ccc(c(c1)OC)OC)c([nH]2)C(=O)O

STK848988
Synonyms: (6E)- 7- imino- 2- methyl- 6- [(4- oxo- 4H- chromen- 3- yl)methylidene]- 6,7- dihydro- 5H- [1,2]oxazolo[2,3- a]pyrimidin- 5- one
Smiles: Cc1on2c(=NC(=O)/C(=C/c3coc4c(c3=O)cccc4)/C2=N)c1

STK578330
Synonyms: N- [(2E)- 5- [(4- chlorobenzyl)sulfonyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- methylpropanamide
Smiles: CC(C(=O)/N=c/1\[nH]nc(s1)S(=O)(=O)Cc1ccc(cc1)Cl)C

STK848989
Synonyms: 3- (2- hydroxyphenyl)- 4- (3- hydroxyphenyl)- 5- propyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCCN1C(=O)c2c(C1c1cccc(c1)O)c([nH]n2)c1ccccc1O

STK578338
Synonyms: 4- [(4Z)- 4- (3,4- dimethoxybenzylidene)- 5- oxo- 2- phenyl- 4,5- dihydro- 1H- imidazol- 1- yl]benzoicacid
Smiles: COc1ccc(cc1OC)/C=C/1\N=C(N(C1=O)c1ccc(cc1)C(=O)O)c1ccccc1

STK578342
Synonyms: 5- ({3- [(5E)- 5- (4- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)C(=O)O)O)CCN1C(=S)S/C(=C/c2ccc(cc2)F)/C1=O

STK848990
Synonyms: N- [(2Z)- 6- methoxy- 1,3- benzothiazol- 2(3H)- ylidene]- 7- methyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: COc1ccc2c(c1)s/c(=N\C(=O)c1cc(=O)c3c(o1)cc(cc3)C)/[nH]2

STK578344
Synonyms: 6- fluoro- N- (4- iodophenyl)- 2- methylquinoline- 4- carboxamide
Smiles: Ic1ccc(cc1)NC(=O)c1cc(C)nc2c1cc(F)cc2

STK848993
Synonyms: 5- tert- butyl- N- cyclopentyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CC(c1cc(NC2CCCC2)n2c(n1)c(cn2)c1ccccc1)(C)C

STK578345
Synonyms: 2,4- dichloro- N- [(1Z)- 1- {1- cyano- 2- [(3- methylbutyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1Cl)Cl)/C(=O)NCCC(C)C

STK848994
Synonyms: propyl4- [(7- ethoxy- 4- oxo- 4H- chromen- 3- yl)oxy]benzoate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OCC

STK578350
Synonyms: 2- {[4- (2- fluorophenyl)- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 3- yl]methyl}phthalazin- 1(2H)- one
Smiles: S=c1[nH]nc(n1c1ccccc1F)Cn1ncc2c(c1=O)cccc2

STK578352
Synonyms: N- (3- chloro- 4- methylphenyl)- 5- (2- hydroxy- 5- methylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(c(c1)c1[nH]nc(c1)C(=O)Nc1ccc(c(c1)Cl)C)O

STK848997
Synonyms: 1- (3- methoxypropyl)- N,N,9- trimethyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)N(C)C

STK578354
Synonyms: 4- [4- (2- fluorophenyl)piperazin- 1- yl]- 5,8- dimethyl- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1n2C)N1CCN(CC1)c1ccccc1F

STK578356
Synonyms: (2Z)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)- 1- [2- (4- ethylphenyl)- 4- methyl- 1,3- thiazol- 5- yl]ethanone
Smiles: COc1cc2/C(=C/C(=O)c3sc(nc3C)c3ccc(cc3)CC)/NCCc2cc1OC

STK578367
Synonyms: 1- (4- methoxyphenyl)- 2- methyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1)C1N(C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK848999
Synonyms: 5- [(2- methylprop- 2- en- 1- yl)oxy]- 2- [5- phenyl- 6- (trifluoromethyl)pyrimidin- 4- yl]phenol
Smiles: CC(=C)COc1ccc(c(c1)O)c1ncnc(c1c1ccccc1)C(F)(F)F

STK578371
Synonyms: 5- {[(E)- (2,4- dioxo- 2H- chromen- 3(4H)- ylidene)methyl]amino}- 2- hydroxybenzoicacid
Smiles: O=C1Oc2ccccc2C(=O)/C/1=C\Nc1ccc(c(c1)C(=O)O)O

STK578375
Synonyms: 3- (2,3- dihydro- 1,4- benzodioxin- 2- yl)- N- (2- methoxy- 5- nitrophenyl)propanamide
Smiles: COc1ccc(cc1NC(=O)CCC1COc2c(O1)cccc2)[N+](=O)[O-]

STK578377
Synonyms: N- [(9- oxo- 9H- fluoren- 4- yl)carbonyl]- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)c1cccc2c1c1ccccc1C2=O

STK849001
Synonyms: 3- methoxy- N- [(2E)- 6- (morpholin- 4- ylsulfonyl)- 1,3- benzothiazol- 2(3H)- ylidene]benzamide
Smiles: COc1cccc(c1)C(=O)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)N1CCOCC1

STK578389
Synonyms: N- (3,4- dimethoxybenzyl)- 5- fluoro- N- [2- (morpholin- 4- yl)ethyl]- 1H- indole- 2- carboxamide
Smiles: COc1cc(ccc1OC)CN(C(=O)c1cc2c([nH]1)ccc(c2)F)CCN1CCOCC1

STK578390
Synonyms: 5- oxo- 3- phenoxy- 5H- anthra[1,9- cd][1,2]oxazol- 6- yl3- fluorobenzoate
Smiles: Fc1cccc(c1)C(=O)Oc1c2C(=O)C=C(c3c2c(c2c1cccc2)on3)Oc1ccccc1

STK849002
Synonyms: 4- oxo- N- [(2E)- 5- (prop- 2- en- 1- ylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4H- chromene- 2- carboxamide
Smiles: C=CCSc1n[nH]/c(=N\C(=O)c2cc(=O)c3c(o2)cccc3)/s1

STK578394
Synonyms: 3- cyclopentyl- 2- ethyl- 10- methylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CCc1nc2c(c(=O)n1C1CCCC1)c(=O)c1c(n2C)cccc1

STK849004
Synonyms: 3- (4- chlorophenyl)- 2- methyl- 5- phenylpyrazine1,4- dioxide
Smiles: Clc1ccc(cc1)c1c(C)[n+]([O-])cc([n+]1[O-])c1ccccc1

STK849005
Synonyms: 3- (2- methoxyphenyl)- 5- methyl- 7- (4- phenylpiperazin- 1- yl)pyrazolo[1,5- a]pyrimidine
Smiles: COc1ccccc1c1cnn2c1nc(C)cc2N1CCN(CC1)c1ccccc1

STK849006
Synonyms: 2- [2- amino- 5- (4- chlorophenyl)pyrimidin- 4- yl]- 5- ethoxyphenol
Smiles: CCOc1ccc(c(c1)O)c1nc(N)ncc1c1ccc(cc1)Cl

STK578396
Synonyms: (1E,2E)- 1- {2- (4- hydroxyphenyl)- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}- 3- phenylprop- 2- en- 1- olate
Smiles: Oc1ccc(cc1)C1/C(=C(/C=C/c2ccccc2)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STK578400
Synonyms: 2- (2- amino- 5- phenylpyrimidin- 4- yl)- 5- [(2,5- dimethylbenzyl)oxy]phenol
Smiles: Nc1ncc(c(n1)c1ccc(cc1O)OCc1cc(C)ccc1C)c1ccccc1

STK578407
Synonyms: tert- butyl[(2S)- 1- {(2E)- 2- [(6- methoxyquinolin- 2- yl)methylidene]hydrazinyl}- 4- (methylsulfanyl)- 1- oxobutan- 2- yl]carbamate(non- preferredname)
Smiles: CSCC[C@@H](C(=O)N/N=C/c1ccc2c(n1)ccc(c2)OC)NC(=O)OC(C)(C)C

STK578408
Synonyms: [2- methyl- 1,1- dioxido- 4- (prop- 2- en- 1- yloxy)- 2H- 1,2- benzothiazin- 3- yl](morpholin- 4- yl)methanone
Smiles: C=CCOC1=C(C(=O)N2CCOCC2)N(C)S(=O)(=O)c2c1cccc2

STK578410
Synonyms: (5Z)- 2,6- dihydroxy- 5- [(2- phenyl- 1H- indol- 3- yl)methylidene]pyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C\c2c([nH]c3c2cccc3)c2ccccc2)/C(=N1)O

STK578415
Synonyms: 1- {1- [6- (cyclopentylamino)- 2- phenylpyrimidin- 4- yl]- 5- methyl- 1H- pyrazol- 4- yl}ethanone
Smiles: CC(=O)c1cnn(c1C)c1cc(NC2CCCC2)nc(n1)c1ccccc1

STK849010
Synonyms: 5- (quinolin- 2- yl)- 4- [3- (trifluoromethyl)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1cccc(c1)C(F)(F)F)c1ccc2c(n1)cccc2

STK578420
Synonyms: 3- [8,9- diphenyl- 2- (pyridin- 4- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 7- yl]- N,N- dimethylpropan- 1- amine
Smiles: CN(CCCn1c(c2ccccc2)c(c2c1ncn1c2nc(n1)c1ccncc1)c1ccccc1)C

STK578424
Synonyms: 2- (furan- 2- yl)- 9- propyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CCCN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1ccco1

STK578425
Synonyms: 5- (2- hydroxy- 5- methylphenyl)- N- {4- [(2- methylpiperidin- 1- yl)sulfonyl]phenyl}- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(c(c1)c1[nH]nc(c1)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCCC1C)O

STK578428
Synonyms: 2- [4- (3- methoxyphenyl)piperazin- 1- yl]- 6- (2- methylphenyl)pyrimidin- 4- ol
Smiles: COc1cccc(c1)N1CCN(CC1)c1nc(O)cc(n1)c1ccccc1C

STK849011
Synonyms: 2,5- dimethyl- 3- (4- methylphenyl)- N- (pyridin- 2- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1ccc(cc1)c1c(C)nn2c1nc(C)cc2NCc1ccccn1

STK849012
Synonyms: N- [4- (4- methoxyphenyl)- 1,2,5- oxadiazol- 3- yl]- 2- methylpropanamide
Smiles: COc1ccc(cc1)c1nonc1NC(=O)C(C)C

STK849013
Synonyms: N- {4- [(2- methyl- 3- phenyl- 6,7- dihydro- 5H- cyclopenta[d]pyrazolo[1,5- a]pyrimidin- 8- yl)amino]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1c2CCCc2nc2n1nc(c2c1ccccc1)C

STK578439
Synonyms: 2- ({7- [3- (dimethylamino)propyl]- 5,6- dimethyl- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl}amino)ethanol
Smiles: OCCNc1ncnc2c1c(C)c(n2CCCN(C)C)C

STK849015
Synonyms: N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- 2- phenoxy- N- (tetrahydrofuran- 2- ylmethyl)acetamide
Smiles: O=C(N(Cc1cc2ccccc2[nH]c1=O)CC1CCCO1)COc1ccccc1

STK849016
Synonyms: 2- [(3- bromobenzyl)amino]- 6,7- dihydro- 5H- cyclopenta[d][1,2,4]triazolo[1,5- a]pyrimidin- 8- ol
Smiles: Brc1cccc(c1)CNc1nc2n(n1)c(O)c1c(n2)CCC1

STK578447
Synonyms: N- [(2E)- 3- (3- methoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclohexanecarboxamide
Smiles: COc1cccc(c1)N1/C(=N\C(=O)C2CCCCC2)/SC2C1CS(=O)(=O)C2

STK578448
Synonyms: 7- chloro- 1- (3- ethoxyphenyl)- 6- methyl- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cccc(c1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK578449
Synonyms: 4- {[(2Z)- 5,5- dioxido- 3- (prop- 2- en- 1- yl)tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]amino}- 4- oxobutanoicacid
Smiles: C=CCN1/C(=N/C(=O)CCC(=O)O)/SC2C1CS(=O)(=O)C2

STK849017
Synonyms: ethyl2- methyl- 4- (pyridin- 3- yl)- 4,10- dihydropyrimido[1,2- a]benzimidazole- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1cccnc1)c1ccccc1[nH]2

STK578454
Synonyms: 8- (furan- 2- ylmethyl)- 4- hydroxy- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Oc1nc(=O)n(c2c1n1c(n2)n(c(c1C)C)Cc1ccco1)C

STK578455
Synonyms: (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)[3- (trifluoromethyl)phenyl]methanone
Smiles: COc1cc2CCN(C(c2cc1OC)C)C(=O)c1cccc(c1)C(F)(F)F

STK578456
Synonyms: 8- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 3- (3- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(C)c(c2=O)Oc1cccc(c1)OC

STK578457
Synonyms: 2- [(4- butyl- 6- chloro- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)NCc1ccncc1

STK578462
Synonyms: methyl3- {[(2,4- dimethylphenyl)sulfonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NS(=O)(=O)c1ccc(cc1C)C)cccc2

STK578463
Synonyms: (5E)- 2- (3,4- dihydroisoquinolin- 2(1H)- yl)- 5- (4- methylbenzylidene)- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: Cc1ccc(cc1)/C=C\1/SC(N=C1O)N1CCc2c(C1)cccc2

STK849021
Synonyms: ethyl5- [(dimethylcarbamoyl)oxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)N(C)C)c1ccccc1

STK578468
Synonyms: N- [4- (1H- indol- 3- yl)butanoyl]alanine
Smiles: O=C(NC(C(=O)O)C)CCCc1c[nH]c2c1cccc2

STK849022
Synonyms: 3- amino- 1- (4- chlorophenyl)- 1H- [1,3,5]triazino[1,2- a]quinazolin- 6- ol
Smiles: Clc1ccc(cc1)C1N=C(N)N=c2n1c1ccccc1c(n2)O

STK849023
Synonyms: 5- tert- butyl- 3- (4- chlorophenyl)- N- [3- (morpholin- 4- yl)propyl]pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CC(c1cc(NCCCN2CCOCC2)n2c(n1)c(cn2)c1ccc(cc1)Cl)(C)C

STK578471
Synonyms: (2E)- 2- (4- hydroxy- 2- oxo- 1,3- thiazol- 5(2H)- ylidene)- N- (5- methyl- 1,3,4- thiadiazol- 2- yl)ethanamide
Smiles: Cc1nnc(s1)NC(=O)/C=C\1/SC(=O)N=C1O

STK578479
Synonyms: {[(2Z)- 2- (3- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}aceticacid
Smiles: OC(=O)COc1ccc2c(c1)O/C(=C\c1cccc(c1)Br)/C2=O

STK578480
Synonyms: 4- methyl- N'- [(E)- (2- methyl- 2H- chromen- 3- yl)methylidene]benzenesulfonohydrazide
Smiles: Cc1ccc(cc1)S(=O)(=O)N/N=C/C1=Cc2ccccc2OC1C

STK849025
Synonyms: 3- phenyl- 5- propyl- N- (pyridin- 2- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CCCc1cc(NCc2ccccn2)n2c(n1)c(cn2)c1ccccc1

STK578482
Synonyms: (2S)- 2- amino- 4- methyl- N'- [(E)- quinolin- 6- ylmethylidene]pentanehydrazide(non- preferredname)
Smiles: CC(C[C@@H](C(=O)N/N=C/c1ccc2c(c1)cccn2)N)C

STK578485
Synonyms: N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 2- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2cccs2)/C1=O)NCCc1c[nH]c2c1cc(F)cc2

STK578486
Synonyms: 3- {[bis(2- methylpropyl)ammonio]methyl}- 2,6- dimethylquinolin- 4- olate
Smiles: CC(C[NH+](Cc1c(C)nc2c(c1[O-])cc(cc2)C)CC(C)C)C

STK578489
Synonyms: (4Z)- 4- [(2,4- dimethylphenyl)imino]- 6- [(4- methylpiperazin- 1- yl)methyl]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: CN1CCN(CC1)Cc1nc(N)n/c(=N\c2ccc(cc2C)C)/[nH]1

STK578493
Synonyms: N- [(2- hydroxyquinolin- 4- yl)methyl]- N- (4- methoxyphenyl)- 2- methylpropanamide
Smiles: COc1ccc(cc1)N(C(=O)C(C)C)Cc1cc(O)nc2c1cccc2

STK849026
Synonyms: 3- {[3- (trifluoromethyl)phenyl]amino}- 2- benzofuran- 1(3H)- one
Smiles: O=C1OC(c2c1cccc2)Nc1cccc(c1)C(F)(F)F

STK578496
Synonyms: (5Z)- 3- cyclohexyl- 6- hydroxy- 5- {1- [(tetrahydrofuran- 2- ylmethyl)amino]ethylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C(/NCC2CCCO2)\C)/C(=O)N1C1CCCCC1

STK578498
Synonyms: methyl2- [(4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)amino]- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC2OC(=O)c3c2ccc(c3OC)OC)sc2c1CCC2

STK849029
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 5- methyl- 3- phenyl- 2- (trifluoromethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: COc1cc(CCNc2cc(C)nc3n2nc(c3c2ccccc2)C(F)(F)F)ccc1OC

STK578508
Synonyms: 2- (3,4- dimethoxybenzyl)- 2,3- dihydro- 1H- isoindol- 1- imine
Smiles: COc1cc(ccc1OC)CN1Cc2c(C1=N)cccc2

STK578509
Synonyms: (3R)- N- {(2S)- 1- [(4- fluorobenzyl)amino]- 3- methyl- 1- oxobutan- 2- yl}- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)[C@H](C(C)C)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

STK578510
Synonyms: N- (3- bromobenzyl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- methylbenzamide
Smiles: Brc1cccc(c1)CN(C(=O)c1ccccc1C)C1CCS(=O)(=O)C1

STK578511
Synonyms: 3- bromo- N- [1- (1- ethyl- 1H- benzimidazol- 2- yl)- 3- methyl- 1H- pyrazol- 5- yl]benzamide
Smiles: CCn1c(nc2c1cccc2)n1nc(cc1NC(=O)c1cccc(c1)Br)C

STK849033
Synonyms: 3- (3,4- dimethoxyphenyl)- 4- oxo- 4H- chromen- 7- yl2,2- dimethylpropanoate
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc(c2)OC(=O)C(C)(C)C

STK578513
Synonyms: 4- imino- 9,10- dimethoxy- 2- (4- methoxyphenyl)- 6,7- dihydro- 4H- pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: COc1ccc(cc1)c1cc2c3cc(OC)c(cc3CCn2c(=N)c1C#N)OC

STK578516
Synonyms: {1- [2- (4- fluorophenoxy)ethyl]- 1H- benzimidazol- 2- yl}(phenyl)methanol
Smiles: Fc1ccc(cc1)OCCn1c(nc2c1cccc2)C(c1ccccc1)O

STK578519
Synonyms: N- tert- butyl- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)NC(C)(C)C

STK578522
Synonyms: N- [3- (4- chlorophenyl)- 4- oxo- 4H- chromen- 2- yl]thiophene- 2- carboxamide
Smiles: Clc1ccc(cc1)c1c(NC(=O)c2cccs2)oc2c(c1=O)cccc2

STK578528
Synonyms: 7- [(3,4- dichlorobenzyl)oxy]- 3- (2- methoxyphenyl)- 4H- chromen- 4- one
Smiles: COc1ccccc1c1coc2c(c1=O)ccc(c2)OCc1ccc(c(c1)Cl)Cl

STK578529
Synonyms: 7- benzyl- 6- hydroxy- 8- [(2- hydroxypropyl)amino]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(CNc1nc2c(n1Cc1ccccc1)c(O)nc(=O)n2C)O

STK849035
Synonyms: 5- (furan- 2- yl)- 2- methyl- 7- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Cc1nn2c(=NC(=CC2c2ccccc2)c2ccco2)[nH]1

STK578531
Synonyms: 6- hydroxy- 3- methyl- 8- (3- methylpiperidin- 1- yl)- 7- {2- [(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]ethyl}- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC1CCCN(C1)c1nc2c(n1CCSc1nnc(s1)C)c(O)nc(=O)n2C

STK578533
Synonyms: 6- hydroxy- 7- (2- hydroxy- 2- phenylethyl)- 3- methyl- 8- (piperidin- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(c1ccccc1)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCCCC1

STK578536
Synonyms: 4- {(2E)- 2- [(3,5- dimethyl- 1- phenyl- 1H- pyrazol- 4- yl)methylidene]hydrazinyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)N/N=C/c1c(C)nn(c1C)c1ccccc1

STK578537
Synonyms: 5- [(4- ethenylbenzyl)oxy]- 2- [4- (4- methoxyphenyl)- 3- methyl- 1,2- oxazol- 5- yl]phenol
Smiles: COc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1ccc(cc1)C=C

STK578540
Synonyms: 6- chloro- 4- {[4- (diphenylmethyl)piperazin- 1- yl]methyl}- 7- methyl- 2H- chromen- 2- one
Smiles: O=c1cc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(o1)cc(c(c2)Cl)C

STK578542
Synonyms: 7- benzyl- 8- chloro- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Oc1nc(=O)n(c2c1n(Cc1ccccc1)c(n2)Cl)C

STK849036
Synonyms: N- {2- [(4- methoxyphenyl)carbamoyl]- 1- benzofuran- 3- yl}- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1oc2c(c1NC(=O)c1cc(=O)c3c(o1)cccc3)cccc2

STK578547
Synonyms: N,N- dimethyl- 1,4- dioxa- 8- azaspiro[4.5]decane- 8- sulfonamide
Smiles: CN(S(=O)(=O)N1CCC2(CC1)OCCO2)C

STK849037
Synonyms: N,1- bis(3- methoxypropyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCNC(=O)c1cc2c(n1CCCOC)nc1n(c2=O)cccc1

STK849038
Synonyms: 4- fluoro- N- [5- hydroxy- 2- (trifluoromethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1cc(O)nc2n1nc(n2)C(F)(F)F

STK578555
Synonyms: 1- (3- methoxyphenyl)- 5,7- dimethyl- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cccc(c1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)c(C)cc(c1)C

STK578564
Synonyms: 2- (2- methoxyethyl)- 1- (3,4,5- trimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COCCN1C(=O)c2c(C1c1cc(OC)c(c(c1)OC)OC)c(=O)c1c(o2)cccc1

STK849039
Synonyms: 2- (1,3- benzothiazol- 2- yl)- 4- hydroxy- 6- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]pyridin- 3- one
Smiles: Cc1cc(O)c2c(n1)[nH]n(c2=O)c1nc2c(s1)cccc2

STK578565
Synonyms: methylN- [(3- chloro- 4- methoxyphenyl)carbamoyl]- L- leucinate
Smiles: COC(=O)[C@@H](NC(=O)Nc1ccc(c(c1)Cl)OC)CC(C)C

STK578573
Synonyms: N- [2- (1- methyl- 5- nitro- 1H- benzimidazol- 2- yl)ethyl]- 2- [2- methyl- 5- (propan- 2- yl)phenoxy]acetamide
Smiles: O=C(COc1cc(ccc1C)C(C)C)NCCc1nc2c(n1C)ccc(c2)[N+](=O)[O-]

STK578574
Synonyms: 2- {4- (4- chlorophenyl)- 5- [(naphthalen- 1- ylmethyl)sulfanyl]- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: Clc1ccc(cc1)n1c(SCc2cccc3c2cccc3)nnc1c1ccccn1

STK578577
Synonyms: 4- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 5,8- dimethyl- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1n2C)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK578579
Synonyms: 2- [(7- chloro- 1- hydroxy- 9- oxo- 9H- xanthen- 3- yl)oxy]acetamide
Smiles: NC(=O)COc1cc(O)c2c(c1)oc1c(c2=O)cc(cc1)Cl

STK849041
Synonyms: 2- [2- amino- 5- (3- methoxyphenoxy)pyrimidin- 4- yl]- 5- [(2- fluorobenzyl)oxy]phenol
Smiles: COc1cccc(c1)Oc1cnc(nc1c1ccc(cc1O)OCc1ccccc1F)N

STK578588
Synonyms: 4- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 6- methyl- 2H- chromen- 2- one
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1cc(=O)oc2c1cc(C)cc2

STK578590
Synonyms: methylN- [(2- methylcyclohexyl)carbamoyl]- D- phenylalaninate
Smiles: COC(=O)[C@@H](Cc1ccccc1)NC(=O)NC1CCCCC1C

STK578591
Synonyms: (5Z)- 6- hydroxy- 3- (3- methoxypropyl)- 5- (2- phenyl- 2,3- dihydro- 1,5- benzothiazepin- 4(5H)- ylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: COCCCN1C(=O)N=C(/C(=C/2\CC(Sc3c(N2)cccc3)c2ccccc2)/C1=O)O

STK578593
Synonyms: ethyl(4- hydroxy- 5- methyl- 2- oxopyrimidin- 1(2H)- yl)acetate
Smiles: CCOC(=O)Cn1cc(C)c(nc1=O)O

STK578595
Synonyms: (2E)- N- [(2Z)- 5- [(4- fluorobenzyl)sulfonyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 3- (4- methylphenyl)prop- 2- enamide
Smiles: Cc1ccc(cc1)/C=C/C(=O)/N=c\1/[nH]nc(s1)S(=O)(=O)Cc1ccc(cc1)F

STK578596
Synonyms: (4Z)- 2- (2- bromophenyl)- 4- (furan- 2- ylmethylidene)- 4H- imidazol- 5- ol
Smiles: OC1=NC(=N/C/1=C\c1ccco1)c1ccccc1Br

STK578599
Synonyms: 12- (furan- 2- yl)- 2- (4- methoxyphenyl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccc(cc1)c1nc2n(n1)cnc1c2C(c2ccco2)C2=C(O1)CCCC2=O

STK849044
Synonyms: N- (4- ethoxyphenyl)- 2,8,10- trimethylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidin- 4- amine
Smiles: CCOc1ccc(cc1)Nc1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK578603
Synonyms: 5- ({[(5Z)- 5- (2- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]acetyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2F)/C1=O)Nc1ccc(c(c1)C(=O)O)O

STK578605
Synonyms: 2- (1,3- benzothiazol- 2- yl)- 4- hydroxy- 6- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]pyridin- 3- one
Smiles: CCCc1cc(O)c2c(n1)[nH]n(c2=O)c1nc2c(s1)cccc2

STK849045
Synonyms: 5- tert- butyl- 3- phenyl- 7- (piperidin- 1- yl)pyrazolo[1,5- a]pyrimidine
Smiles: CC(c1cc(N2CCCCC2)n2c(n1)c(cn2)c1ccccc1)(C)C

STK578609
Synonyms: 4- (2- chlorobenzyl)- 2- (4,6- dimethylpyrimidin- 2- yl)- 5- methyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Cc1cc(C)nc(n1)n1[nH]c(c(c1=O)Cc1ccccc1Cl)C

STK578615
Synonyms: {(5S)- 5- (benzylcarbamoyl)- 3- [3- methoxy- 4- (propan- 2- yloxy)phenyl]- 4,5- dihydro- 1,2- oxazol- 5- yl}aceticacid
Smiles: COc1cc(ccc1OC(C)C)C1=NO[C@@](C1)(CC(=O)O)C(=O)NCc1ccccc1

STK849047
Synonyms: N- (pyridin- 3- ylmethyl)- 4,5,6,7- tetrahydro- 2H- indazole- 3- carboxamide
Smiles: O=C(c1[nH]nc2c1CCCC2)NCc1cccnc1

STK578619
Synonyms: 2,2,5- trimethyl- 8- (piperazin- 1- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCNCC1

STK849048
Synonyms: 5- [(2- fluorobenzyl)oxy]- 2- (5- phenylpyrimidin- 4- yl)phenol
Smiles: Oc1cc(ccc1c1ncncc1c1ccccc1)OCc1ccccc1F

STK578629
Synonyms: N- (3- methoxypropyl)- 1- phenyl- N- (pyridin- 2- ylmethyl)methanesulfonamide
Smiles: COCCCN(S(=O)(=O)Cc1ccccc1)Cc1ccccn1

STK578632
Synonyms: 6- hydroxy- 7- (2- hydroxy- 2- phenylethyl)- 3- methyl- 8- (piperazin- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(c1ccccc1)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCNCC1

STK578636
Synonyms: 7- (2,3- dichlorophenyl)- 5- (4- methoxyphenyl)- 3,7- dihydrotetrazolo[1,5- a]pyrimidine
Smiles: COc1ccc(cc1)C1=CC(c2cccc(c2Cl)Cl)n2c(=N1)[nH]nn2

STK578638
Synonyms: N- [4- (azepan- 1- ylsulfonyl)phenyl]- 5- (2- hydroxy- 3,5- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1cc(C)c(c(c1)c1[nH]nc(c1)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCCCC1)O

STK578639
Synonyms: 2- {methyl[4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- yl]amino}ethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CCCc2c(n1)C(C)C)C

STK578640
Synonyms: (3S,3a'R,8a'S,8b'S)- 7- ethyl- 2'- [2- (trifluoromethyl)phenyl]- 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: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F

STK578641
Synonyms: 2,6- diamino- 4- (2,4,5- trimethoxyphenyl)- 4H- thiopyran- 3,5- dicarbonitrile
Smiles: N#CC1=C(N)SC(=C(C1c1cc(OC)c(cc1OC)OC)C#N)N

STK578642
Synonyms: N- [(4- methylbenzyl)carbamoyl]alanine
Smiles: CC(C(=O)O)NC(=O)NCc1ccc(cc1)C

STK578643
Synonyms: 5- (2- hydroxy- 5- methylphenyl)- N- {2- [(4- methylphenyl)carbamoyl]- 1- benzofuran- 3- yl}- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1oc2c(c1NC(=O)c1n[nH]c(c1)c1cc(C)ccc1O)cccc2

STK578644
Synonyms: 3- [(2- phenyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)amino]propan- 1- ol
Smiles: OCCCNc1nc(nc2c1oc1c2cccc1)c1ccccc1

STK578650
Synonyms: 5- (2- hydroxyphenyl)- N- [3- (methylcarbamoyl)- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl]- 1H- pyrazole- 3- carboxamide
Smiles: CNC(=O)c1c(NC(=O)c2n[nH]c(c2)c2ccccc2O)sc2c1CCCC2

STK578651
Synonyms: 2- (4- ethylphenoxy)- 9,10- dimethoxy- 6,7- dihydro- 4H- pyrimido[6,1- a]isoquinolin- 4- one
Smiles: COc1cc2c(cc1OC)CCn1c2cc(Oc2ccc(cc2)CC)nc1=O

STK578654
Synonyms: N- [3- (2- fluorophenyl)- 1- methyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]furan- 2- carboxamide
Smiles: O=C(c1ccco1)Nc1n(C)c2ccccc2c(=O)c1c1ccccc1F

STK578655
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)c1cccc2c1C(=O)N(C2)c1ccccc1)C

STK578656
Synonyms: 5- [(4- bromobenzyl)oxy]- 2- (3- methyl- 4- phenyl- 1,2- oxazol- 5- yl)phenol
Smiles: Brc1ccc(cc1)COc1ccc(c(c1)O)c1onc(c1c1ccccc1)C

STK578658
Synonyms: 4- (5- {(E)- [2- hydroxy- 1- (4- methylbenzyl)- 5- oxo- 1,5- dihydro- 4H- imidazol- 4- ylidene]methyl}furan- 2- yl)benzoicacid
Smiles: Cc1ccc(cc1)CN1C(=N/C(=C/c2ccc(o2)c2ccc(cc2)C(=O)O)/C1=O)O

STK578661
Synonyms: 9- benzyl- 2- phenyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: c1ccc(cc1)CN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1ccccc1

STK578663
Synonyms: N- {4- [(3,4- dimethyl- 1,2- oxazol- 5- yl)sulfamoyl]phenyl}- 5- (2- hydroxy- 4- methylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(c(c1)O)c1[nH]nc(c1)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1onc(c1C)C

STK849052
Synonyms: (4E)- 1- (2- hydroxyethyl)- 4- [(2E)- 1- hydroxy- 3- phenylprop- 2- en- 1- ylidene]- 5- (4- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\C=C\c2ccccc2)/O)/C1c1ccc(cc1)OC

STK849053
Synonyms: 8- (2,5- dimethoxyphenyl)- 6- oxo- 3- phenyl- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: COc1ccc(c(c1)C1CC(=O)N2C(=C1C#N)SCN(C2)c1ccccc1)OC

STK578670
Synonyms: N- (cyclooctylcarbamoyl)- D- methionine
Smiles: CSCC[C@H](C(=O)O)NC(=O)NC1CCCCCCC1

STK578673
Synonyms: 12- (pyridin- 3- yl)- 2- (thiophen- 2- yl)- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- ol
Smiles: Oc1ccc2c(c1)Oc1c(C2c2cccnc2)c2nc(nn2cn1)c1cccs1

STK578678
Synonyms: 2- (morpholin- 4- ium- 4- yl)- 5- {[4- (propan- 2- yl)benzyl]amino}benzoate
Smiles: [O-]C(=O)c1cc(NCc2ccc(cc2)C(C)C)ccc1[NH+]1CCOCC1

STK578680
Synonyms: 9- (3- chlorophenyl)- 4- hydroxy- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purin- 2(1H)- one
Smiles: Clc1cccc(c1)N1CCCn2c1nc1c2c(O)nc(=O)n1C

STK578685
Synonyms: ({6- cyano- 8,8- dimethyl- 5- [(4- methylphenyl)amino]- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridin- 3- yl}sulfanyl)aceticacid
Smiles: N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccc(cc1)C)c(SCC(=O)O)nn2

STK578691
Synonyms: 4- (2- chloro- 5- nitrophenyl)- 2- [(2,3- dichlorophenyl)amino]- 8- methyl- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: Cc1[nH]c2=NC(=NC(n2c(=O)c1)c1cc(ccc1Cl)[N+](=O)[O-])Nc1cccc(c1Cl)Cl

STK849057
Synonyms: 5- (2- hydroxyethyl)- 3- (2- hydroxyphenyl)- 4- (3,4,5- trimethoxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1cc(OC)c(c(c1)OC)OC)c([nH]n2)c1ccccc1O

STK578696
Synonyms: 8- amino- 7- [2- hydroxy- 3- (3- methylphenoxy)propyl]- 1,3- dimethyl- 3,4,5,7- tetrahydro- 1H- purine- 2,6- dione
Smiles: OC(CN1C(=NC2C1C(=O)N(C)C(=O)N2C)N)COc1cccc(c1)C

STK578701
Synonyms: 6- hydroxy- 3- methyl- 1- phenyl- 4- (3,4,5- trimethoxyphenyl)- 1H- pyrazolo[3,4- b]pyridine- 5- carbonitrile
Smiles: N#Cc1c(O)nc2c(c1c1cc(OC)c(c(c1)OC)OC)c(C)nn2c1ccccc1

STK849062
Synonyms: 4- (2,3- dimethoxyphenyl)- 4,10- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: COc1c(OC)cccc1C1N=C(N)N=c2n1c1ccccc1[nH]2

STK578706
Synonyms: 2- amino- 5- hydroxy- 7- methyl- 4- [4- (methylsulfanyl)phenyl]- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)SC)c(O)nc(c2)C

STK578709
Synonyms: N- [5- hydroxy- 2- (2- phenylethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]furan- 2- carboxamide
Smiles: Oc1cc(NC(=O)c2ccco2)n2c(n1)nc(n2)CCc1ccccc1

STK578711
Synonyms: 2- (2- chlorophenoxy)- N- [3- (4- methylphenyl)- 1,2- oxazol- 5- yl]acetamide
Smiles: O=C(Nc1onc(c1)c1ccc(cc1)C)COc1ccccc1Cl

STK578712
Synonyms: 4- {[4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]methyl}- 6- chloro- 2H- chromen- 2- one
Smiles: Clc1ccc2c(c1)c(CN1CCN(CC1)Cc1ccc3c(c1)OCO3)cc(=O)o2

STK849063
Synonyms: ethyl4- ({7- [(2- methylpropanoyl)oxy]- 4- oxo- 4H- chromen- 3- yl}oxy)benzoate
Smiles: CCOC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OC(=O)C(C)C

STK849064
Synonyms: ethyl4- {[5- (2,4- dihydroxyphenyl)- 3- methyl- 1H- pyrazol- 4- yl]oxy}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Oc1c(C)n[nH]c1c1ccc(cc1O)O

STK578721
Synonyms: 7- (3- bromobenzyl)- 1,3- dimethyl- 8- (pyrrolidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Brc1cccc(c1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCC1

STK849065
Synonyms: 2- (5- chloro- 6- methyl- 1- benzofuran- 3- yl)- N- cyclopentylacetamide
Smiles: O=C(Cc1coc2c1cc(Cl)c(c2)C)NC1CCCC1

STK849066
Synonyms: 2- methyl- 3- phenyl- 5- (propan- 2- yl)- N- (pyridin- 4- yl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CC(c1cc(Nc2ccncc2)n2c(n1)c(c1ccccc1)c(n2)C)C

STK849068
Synonyms: 5- propyl- 2- [(thiophen- 2- ylmethyl)amino][1,2,4]triazolo[1,5- a]pyrimidin- 7(3H)- one
Smiles: CCCc1cc(=O)n2c(n1)[nH]c(n2)NCc1cccs1

STK578727
Synonyms: N'- [5,6- dimethyl- 7- (pyridin- 3- yl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl]- N,N- dimethylpropane- 1,3- diamine
Smiles: CN(CCCNc1ncnc2c1c(C)c(n2c1cccnc1)C)C

STK578733
Synonyms: (5Z)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 3- cyclohexyl- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C/c2ccc3c(c2)OCO3)/C(=O)N1C1CCCCC1

STK578734
Synonyms: 5- [(3- chlorobenzyl)oxy]- 2- [4- (4- methoxyphenyl)- 3- methyl- 1,2- oxazol- 5- yl]phenol
Smiles: COc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1cccc(c1)Cl

STK849070
Synonyms: 2- [(2- ethylpiperidin- 1- yl)carbonyl]- 1- (3- methoxypropyl)- 9- methylpyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 4(1H)- one
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)N1CCCCC1CC

STK578739
Synonyms: 2- [(2,4- dichlorobenzyl)amino]- 3,5,6,7- tetrahydro- 8H- cyclopenta[d][1,2,4]triazolo[1,5- a]pyrimidin- 8- one
Smiles: Clc1ccc(c(c1)Cl)CNc1[nH]c2n(n1)c(=O)c1c(n2)CCC1

STK578740
Synonyms: (3E)- 3- {2- oxo- 2- [2- (prop- 2- en- 1- yloxy)phenyl]ethylidene}- 1,3- dihydro- 2H- indol- 2- one
Smiles: C=CCOc1ccccc1C(=O)/C=C\1/C(=O)Nc2c1cccc2

STK578743
Synonyms: 4- amino- N- (4- fluorobenzyl)- 3- phenyl- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1sc(=S)n(c1N)c1ccccc1

STK578746
Synonyms: N- (2,5- dimethoxybenzyl)- 5,7- dimethyl- N- (prop- 2- en- 1- yl)[1,2,4]triazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: C=CCN(C(=O)c1nn2c(n1)nc(cc2C)C)Cc1cc(OC)ccc1OC

STK849073
Synonyms: 3- (2- methoxyphenyl)- 2,5- dimethyl- N- (propan- 2- yl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: COc1ccccc1c1c(C)nn2c1nc(C)cc2NC(C)C

STK578755
Synonyms: 2- [2- amino- 5- (4- methoxyphenoxy)pyrimidin- 4- yl]- 5- [(3,4- dichlorobenzyl)oxy]phenol
Smiles: COc1ccc(cc1)Oc1cnc(nc1c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl)N

STK849076
Synonyms: 3- (2- chlorophenyl)- 5- methyl- N- [(2Z)- 5- methyl- 4- (4- methylphenyl)- 1,3- thiazol- 2(3H)- ylidene]- 1,2- oxazole- 4- carboxamide
Smiles: Cc1ccc(cc1)c1[nH]/c(=N/C(=O)c2c(C)onc2c2ccccc2Cl)/sc1C

STK578758
Synonyms: 4- (4- ethylphenyl)- 2- (ethylsulfanyl)- 6- hydroxy- 4,5- dihydropyridine- 3- carbonitrile
Smiles: CCSC1=C(C#N)C(CC(=N1)O)c1ccc(cc1)CC

STK578761
Synonyms: N- {[(2E)- 4- (naphthalen- 1- yl)- 1,3- thiazol- 2(3H)- ylidene]carbamothioyl}propanamide
Smiles: CCC(=O)NC(=S)/N=c\1/scc([nH]1)c1cccc2c1cccc2

STK578762
Synonyms: 2- (3,4- dimethoxyphenyl)- 5- (4- methylpiperazin- 1- yl)- 1,3- oxazole- 4- carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C)c1ccc(c(c1)OC)OC

STK578764
Synonyms: 5- tert- butyl- 3- (4- chlorophenyl)- N- (4- ethylphenyl)- 2- methylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CCc1ccc(cc1)Nc1cc(nc2n1nc(c2c1ccc(cc1)Cl)C)C(C)(C)C

STK578767
Synonyms: N- [(3E)- 1- ethyl- 7- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 4- fluorobenzenesulfonamide
Smiles: CCn1[nH]/c(=N/S(=O)(=O)c2ccc(cc2)F)/c2c1nc1cc(C)ccc1c2

STK849078
Synonyms: 1- (3- methoxypropyl)- 2- [(3- methylpiperidin- 1- yl)carbonyl]pyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 4(1H)- one
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)N1CCCC(C1)C

STK578772
Synonyms: 3- ({(1E)- 1- [4- hydroxy- 1- (2- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]propyl}amino)benzoicacid
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/Nc1cccc(c1)C(=O)O

STK578775
Synonyms: N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (pyridin- 3- ylmethyl)benzamide
Smiles: O=C(N(Cc1cc2ccccc2[nH]c1=O)Cc1cccnc1)c1ccccc1

STK578781
Synonyms: 12- (furan- 2- yl)- 2- (4- methoxyphenyl)- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- ol
Smiles: COc1ccc(cc1)c1nc2n(n1)cnc1c2C(c2ccco2)c2c(O1)cc(cc2)O

STK578782
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 4- hydroxy- 1,3- diazaspiro[5.5]undeca- 1,3- diene- 5- carbonitrile
Smiles: N#CC1C(=NC(=NC21CCCCC2)N1CCN(CC1)Cc1ccc2c(c1)OCO2)O

STK578789
Synonyms: 5- (2- hydroxyphenyl)- N- {2- [(4- methylphenyl)carbonyl]- 1- benzofuran- 3- yl}- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(cc1)C(=O)c1oc2c(c1NC(=O)c1n[nH]c(c1)c1ccccc1O)cccc2

STK849079
Synonyms: N- [4- (3,4- dimethoxyphenyl)- 1,2,5- oxadiazol- 3- yl]- 3- methylbutanamide
Smiles: COc1cc(ccc1OC)c1nonc1NC(=O)CC(C)C

STK578791
Synonyms: N- [(3- chloro- 4- methoxyphenyl)carbamoyl]- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)Nc1ccc(c(c1)Cl)OC

STK578793
Synonyms: 4- (ethylsulfanyl)- 2- (3- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: CCSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)OC

STK578794
Synonyms: 1- (2- phenyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)pyrrolidinium- 2- carboxylate
Smiles: [O-]C(=O)C1CCC[NH+]1c1nc(nc2c1oc1c2cccc1)c1ccccc1

STK849083
Synonyms: N- [(2Z)- 6- methoxy- 1,3- benzothiazol- 2(3H)- ylidene]- 6- methyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: COc1ccc2c(c1)s/c(=N\C(=O)c1cc(=O)c3c(o1)ccc(c3)C)/[nH]2

STK578796
Synonyms: (2'S,3S,3'S,10b'R)- 2'- (furan- 2- ylcarbonyl)- 3'- (pyridin- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)cccc3)c1ccccn1

STK578798
Synonyms: N- (furan- 2- ylmethyl)- 5- methoxy- 3- methyl- 1H- indole- 2- carboxamide
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)NCc1ccco1

STK578799
Synonyms: 4- [(4- fluorophenyl)carbonyl]- 2- [3- (trifluoromethyl)phenyl]hexahydropyrrolo[3,4- a]pyrrolizine- 1,3(2H,4H)- dione
Smiles: Fc1ccc(cc1)C(=O)C1N2CCCC2C2C1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F

STK578804
Synonyms: 5- (2- fluorophenyl)- 4- {[(1E,2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/C=C/c1ccco1

STK578805
Synonyms: 2- [(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (1,1- dioxidotetrahydrothiophen- 3- yl)acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2)/C1=O)NC1CCS(=O)(=O)C1

STK578807
Synonyms: (4E)- 4- [(4- ethoxyphenyl)(hydroxy)methylidene]- 1- [2- (2- hydroxyethoxy)ethyl]- 5- (pyridin- 2- yl)pyrrolidine- 2,3- dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OCC)/O)/C1c1ccccn1

STK578808
Synonyms: 2- chloro- N- [(2Z)- 5- [(2- fluorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: Fc1ccccc1CSc1n[nH]/c(=N/C(=O)c2ccccc2Cl)/s1

STK849085
Synonyms: 2- methyl- 3- phenyl- N- (pyridin- 2- ylmethyl)- 6,7- dihydro- 5H- cyclopenta[d]pyrazolo[1,5- a]pyrimidin- 8- amine
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2NCc2ccccn2)CCC1

STK578814
Synonyms: 2- [2- amino- 5- (4- chlorophenyl)- 6- (trifluoromethyl)pyrimidin- 4- yl]- 5- [(3- chlorobenzyl)oxy]phenol
Smiles: Nc1nc(c2ccc(cc2O)OCc2cccc(c2)Cl)c(c(n1)C(F)(F)F)c1ccc(cc1)Cl

STK578821
Synonyms: (5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)[4- (diphenylmethyl)piperazin- 1- yl]methanone
Smiles: Cc1cc(C)n2c(n1)nc(n2)C(=O)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK578825
Synonyms: 7- [4- (5- chloro- 2- methoxybenzyl)piperazin- 1- yl]- 3- phenyl- 5- (propan- 2- yl)pyrazolo[1,5- a]pyrimidine
Smiles: COc1ccc(cc1CN1CCN(CC1)c1cc(nc2n1ncc2c1ccccc1)C(C)C)Cl

STK578826
Synonyms: 4- [(4Z)- 4- (1,3- benzodioxol- 5- ylmethylidene)- 2- methyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl]benzoicacid
Smiles: CC1=N/C(=C\c2ccc3c(c2)OCO3)/C(=O)N1c1ccc(cc1)C(=O)O

STK578831
Synonyms: 2,2'- {[5- (2- methylpropyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- yl]imino}diethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C)CCO

STK578834
Synonyms: 5- (3,4- dimethoxyphenyl)- 4- imino- 3- [3- (morpholin- 4- yl)propyl]- 3,5- dihydro- 4H- chromeno[2,3- d]pyrimidin- 8- ol
Smiles: COc1ccc(cc1OC)C1c2ccc(cc2Oc2c1c(=N)n(cn2)CCCN1CCOCC1)O

STK578836
Synonyms: 2- {[3- (dimethylamino)propyl]amino}- 3- (4- methoxyphenyl)- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)n1c(NCCCN(C)C)nc2c(c1=O)c1CCCCCc1s2

STK578837
Synonyms: 5- (benzyloxy)- 2- [4- (4- methoxyphenyl)- 3- (trifluoromethyl)- 1H- pyrazol- 5- yl]phenol
Smiles: COc1ccc(cc1)c1c([nH]nc1C(F)(F)F)c1ccc(cc1O)OCc1ccccc1

STK849088
Synonyms: 5- tert- butyl- 3- (2- chlorophenyl)- 7- (1H- imidazol- 1- yl)pyrazolo[1,5- a]pyrimidine
Smiles: Clc1ccccc1c1cnn2c1nc(cc2n1cncc1)C(C)(C)C

STK578849
Synonyms: 2- amino- 5- (3,4- dimethoxyphenyl)- 6- hydroxy- 5,7,8,9- tetrahydropyrimido[4,5- b]quinolin- 4(3H)- one
Smiles: COc1ccc(cc1OC)C1C2=C(O)CCCC2=Nc2c1c(=O)[nH]c(n2)N

STK578855
Synonyms: 2- [(4- ethoxyphenyl)sulfonyl]- 6,7- dimethoxy- 1- methyl- 1,2,3,4- tetrahydroisoquinoline
Smiles: CCOc1ccc(cc1)S(=O)(=O)N1CCc2c(C1C)cc(c(c2)OC)OC

STK578861
Synonyms: N- (9- ethyl- 9H- carbazol- 3- yl)- 3- methyl- 4- oxo- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: CCn1c2ccc(cc2c2c1cccc2)NC(=O)c1oc2c(c1C)C(=O)CCC2

STK578862
Synonyms: N- [4- (1,3- dimethyl- 2,4- dioxo- 5- phenyl- 1,2,3,4- tetrahydro- 6H- pyrrolo[3,4- d]pyrimidin- 6- yl)phenyl]furan- 2- carboxamide
Smiles: O=C(c1ccco1)Nc1ccc(cc1)n1cc2c(c1c1ccccc1)c(=O)n(c(=O)n2C)C

STK578863
Synonyms: 6- chloro- 4- {[4- (2- fluorophenyl)piperazin- 1- yl]methyl}- 5,7- dimethyl- 2H- chromen- 2- one
Smiles: O=c1cc(CN2CCN(CC2)c2ccccc2F)c2c(o1)cc(c(c2C)Cl)C

STK578864
Synonyms: ethyl10- (furan- 2- yl)- 8- methyl- 2- (2- methylphenyl)- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 9- carboxylate
Smiles: CCOC(=O)C1=C(C)Oc2c(C1c1ccco1)c1nc(nn1cn2)c1ccccc1C

STK578865
Synonyms: ethyl1- [(5- fluoro- 1H- indol- 2- yl)carbonyl]piperidine- 3- carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C(=O)c1cc2c([nH]1)ccc(c2)F

STK578870
Synonyms: {[(2Z)- 3- oxo- 2- (thiophen- 2- ylmethylidene)- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}aceticacid
Smiles: OC(=O)COc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O

STK578876
Synonyms: N- (1H- indol- 3- ylacetyl)phenylalanine
Smiles: O=C(Cc1c[nH]c2c1cccc2)NC(C(=O)O)Cc1ccccc1

STK578880
Synonyms: [4- (2,3- dimethylphenyl)piperazin- 1- yl](1H- indol- 7- yl)methanone
Smiles: Cc1c(C)cccc1N1CCN(CC1)C(=O)c1cccc2c1[nH]cc2

STK578882
Synonyms: 9,10- dimethoxy- 2- (pyridin- 3- ylmethoxy)- 6,7- dihydro- 4H- pyrimido[6,1- a]isoquinolin- 4- one
Smiles: COc1cc2c(cc1OC)CCn1c2cc(OCc2cccnc2)nc1=O

STK849091
Synonyms: 5- methoxy- 2- [4- (4- methyl- 1,3- thiazol- 2- yl)- 1H- pyrazol- 3- yl]phenol
Smiles: COc1ccc(c(c1)O)c1n[nH]cc1c1scc(n1)C

STK578890
Synonyms: 4- chloro- N- [5- hydroxy- 2- (4- methoxyphenyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]benzamide
Smiles: COc1ccc(cc1)c1nc2n(n1)c(cc(n2)O)NC(=O)c1ccc(cc1)Cl

STK849092
Synonyms: 1- {2- [(3- oxido- 3,4- dihydro- 2H- 1,5,3- benzodioxaphosphepin- 3- yl)oxy]ethyl}pyrrolidine- 2,5- dione
Smiles: O=C1CCC(=O)N1CCOP1(=O)COc2c(OC1)cccc2

STK578897
Synonyms: (4E)- 4- (1,3- benzodioxol- 5- ylmethylidene)- 2- (2,4- dichlorophenyl)- 4H- imidazol- 5- ol
Smiles: Clc1ccc(c(c1)Cl)C1=N/C(=C/c2ccc3c(c2)OCO3)/C(=N1)O

STK578898
Synonyms: 3'- tert- butyl- 3- (2- fluorophenyl)- 6'- hydroxy- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: Fc1ccccc1N1CCN2C(C1)C1(Cc3c2cccc3)C(=NC(=O)N(C1=O)C(C)(C)C)O

STK578902
Synonyms: 2- [7- (3,5- dimethylphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]phenol
Smiles: Cc1cc(C)cc(c1)n1ncc2c1ncn1c2nc(n1)c1ccccc1O

STK849093
Synonyms: 3- (2- phenylethyl)- 3,4,8,9- tetrahydro- 2H- cyclopenta[3,4]chromeno[8,7- e][1,3]oxazin- 6(7H)- one
Smiles: O=c1oc2c3CN(COc3ccc2c2c1CCC2)CCc1ccccc1

STK578903
Synonyms: N- (1- {[2- (1H- benzimidazol- 2- yl)ethyl]amino}- 3- methyl- 1- oxobut- 2- en- 2- yl)- 2- chlorobenzamide
Smiles: CC(=C(C(=O)NCCc1nc2c([nH]1)cccc2)NC(=O)c1ccccc1Cl)C

STK578904
Synonyms: ethyl4- (4- hydroxyphenyl)- 2- methyl- 4,10- dihydropyrimido[1,2- a]benzimidazole- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)O)c1ccccc1[nH]2

STK578905
Synonyms: 8- methoxy- 5- methyl- 4- (3- methylpiperidin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: COc1ccc2c(c1)c1ncnc(c1n2C)N1CCCC(C1)C

STK578907
Synonyms: 5- (benzyloxy)- 2- (3- methyl- 4- phenyl- 1,2- oxazol- 5- yl)phenol
Smiles: Oc1cc(OCc2ccccc2)ccc1c1onc(c1c1ccccc1)C

STK849097
Synonyms: 2- cyclopropyl- 1- [(2,2- dichlorocyclopropyl)methyl]- 1H- benzimidazole
Smiles: ClC1(Cl)CC1Cn1c(nc2c1cccc2)C1CC1

STK849098
Synonyms: 2- methylpropyl(6- bromo- 4- oxoquinazolin- 3(4H)- yl)acetate
Smiles: CC(COC(=O)Cn1cnc2c(c1=O)cc(cc2)Br)C

STK578913
Synonyms: 8,8- dimethyl- 3- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}- 5- (phenylamino)- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridine- 6- carbonitrile
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCC(=O)N3CCCCC3)nnc2c2c1CC(C)(C)OC2

STK578914
Synonyms: ethyl(4- hydroxy- 1H- 1,5- benzodiazepin- 2- yl)acetate
Smiles: CCOC(=O)CC1=CC(=Nc2c(N1)cccc2)O

STK578916
Synonyms: (5Z)- 6- hydroxy- 5- {(2E)- 1- hydroxy- 3- [4- (propan- 2- yl)phenyl]prop- 2- en- 1- ylidene}- 3- (3- methoxypropyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COCCCN1C(=O)N=C(/C(=C(\C=C\c2ccc(cc2)C(C)C)/O)/C1=O)O

STK849099
Synonyms: 6- benzyl- 2- (furan- 2- yl)- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1nc2nc(nn2c(c1Cc1ccccc1)O)c1ccco1

STK578920
Synonyms: 4- amino- N- (4- fluorobenzyl)- 3- methyl- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: O=C(c1sc(=S)n(c1N)C)NCc1ccc(cc1)F

STK849100
Synonyms: 5- (benzyloxy)- 2- [5- (4- methoxyphenyl)pyrimidin- 4- yl]phenol
Smiles: COc1ccc(cc1)c1cncnc1c1ccc(cc1O)OCc1ccccc1

STK849101
Synonyms: 6- chloro- 4- oxo- N- [2- (4- sulfamoylphenyl)ethyl]- 4H- chromene- 2- carboxamide
Smiles: Clc1ccc2c(c1)c(=O)cc(o2)C(=O)NCCc1ccc(cc1)S(=O)(=O)N

STK578933
Synonyms: 8- [(4- ethoxyphenyl)sulfonyl]- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: CCOc1ccc(cc1)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK578939
Synonyms: 1- [1- hydroxy- 3,3- dimethyl- 11- (pyridin- 3- yl)- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl]ethanone
Smiles: OC1=C2C(=Nc3c(N(C2c2cccnc2)C(=O)C)cccc3)CC(C1)(C)C

STK578943
Synonyms: N- (5- hydroxy[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl)- 3,4- dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1cc(O)nc2n1ncn2

STK849102
Synonyms: 3- (4- chlorophenyl)- 5- methyl- N- (pyridin- 2- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)cc2NCc1ccccn1

STK578944
Synonyms: (2E)- 2- cyano- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 3- (2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)prop- 2- enamide
Smiles: N#C/C(=C\c1ccc2c(c1)CC(O2)C)/C(=O)NC1CCS(=O)(=O)C1

STK849103
Synonyms: 4- (2- fluorophenyl)- 5- (pyrazin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccccc1n1c(=S)[nH]nc1c1cnccn1

STK578949
Synonyms: (5Z)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 2- phenyl- 3- (1,3- thiazol- 2- yl)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: O=C1/C(=C/c2ccc3c(c2)OCO3)/N=C(N1c1nccs1)c1ccccc1

STK578950
Synonyms: (4E)- 4- [hydroxy(phenyl)methylidene]- 1- methyl- 5- (4- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])C)/c1ccccc1

STK578951
Synonyms: (5Z)- 5- {[(5- methylpyridin- 2- yl)amino]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: SC1=NC(=O)/C(=C\Nc2ccc(cn2)C)/C(=O)N1

STK578952
Synonyms: N- benzyl- N- butyl- 5,6- dimethoxy- 1H- indole- 2- carboxamide
Smiles: CCCCN(C(=O)c1cc2c([nH]1)cc(c(c2)OC)OC)Cc1ccccc1

STK578954
Synonyms: N- [(4- ethoxyphenyl)carbamoyl]- L- phenylalanine
Smiles: CCOc1ccc(cc1)NC(=O)N[C@H](C(=O)O)Cc1ccccc1

STK849104
Synonyms: 4- (4- chlorophenyl)- 3- (2- hydroxyphenyl)- 5- (3- hydroxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1ccc(cc1)Cl)c([nH]n2)c1ccccc1O

STK578958
Synonyms: 2- {[8,9- di(furan- 2- yl)furo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1N(Cc2nc3n(n2)cnc2c3c(c3ccco3)c(o2)c2ccco2)C(=O)c2c1cccc2

STK578961
Synonyms: N- (3- chloro- 2- methylphenyl)- 5- (2- hydroxy- 3,4- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1O)C)C)Nc1cccc(c1C)Cl

STK578963
Synonyms: 4- ({3- [(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)O)C(=O)O)CCN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK578969
Synonyms: 2- (4,6- dimethylpyrimidin- 2- yl)- 4- hydroxy- 6- methyl- 5- (2- methylbenzyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]pyridin- 3- one
Smiles: Cc1cc(C)nc(n1)n1[nH]c2c(c1=O)c(O)c(c(n2)C)Cc1ccccc1C

STK849106
Synonyms: 5- methyl- 3- (4- methylphenyl)pyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1ccc(cc1)c1cnn2c1nc(C)cc2O

STK578973
Synonyms: N- (4- fluorophenyl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK578977
Synonyms: 1- butyl- 6- oxo- 1,6- dihydropyridazine- 3- carboxylicacid
Smiles: CCCCn1nc(ccc1=O)C(=O)O

STK578979
Synonyms: 2- {[4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]carbonyl}cyclohexanecarboxylicacid
Smiles: OC(=O)C1CCCCC1C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK578980
Synonyms: 2- [(4- butyl- 8- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: CCCCc1cc(=O)oc2c1ccc(c2C)OCC(=O)NCc1ccncc1

STK578988
Synonyms: (2E)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- (4- hydroxy- 3- methoxy- 5- nitrophenyl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1cc(OC)c(c(c1)[N+](=O)[O-])O)/c1scc(n1)c1cccc(c1)Br

STK578991
Synonyms: N- (2- methoxyphenyl)- 5,6- dimethyl- 7- (pyridin- 3- yl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: COc1ccccc1Nc1ncnc2c1c(C)c(n2c1cccnc1)C

STK578992
Synonyms: 4- amino- N- [1,3- dimethyl- 2,4,6- trioxo- 5- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]benzenesulfonamide
Smiles: Nc1ccc(cc1)S(=O)(=O)NC1(C(=O)Nc2c1c(=O)n(c(=O)n2C)C)C(F)(F)F

STK849109
Synonyms: 6- methyl- N- [(2Z)- 5- (methylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: CSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)ccc(c3)C)/s1

STK578997
Synonyms: N- (6- methylpyridin- 2- yl)- 2- (6,7,8,9- tetrahydrodibenzo[b,d]furan- 2- yloxy)acetamide
Smiles: O=C(Nc1cccc(n1)C)COc1ccc2c(c1)c1CCCCc1o2

STK578999
Synonyms: N- (3- chloro- 4- fluorophenyl)- 1- ({1- [(4- methylphenyl)sulfonyl]piperidin- 4- yl}carbonyl)- L- prolinamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1CCC[C@H]1C(=O)Nc1ccc(c(c1)Cl)F

STK849110
Synonyms: N- cyclohexyl- N- ethyl- 1- (3- methoxypropyl)- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)N(C1CCCCC1)CC

STK579010
Synonyms: 4- (4- fluorophenyl)- 5- (pyrazin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccc(cc1)n1c(=S)[nH]nc1c1cnccn1

STK579012
Synonyms: 4,7,7- trimethyl- N- (4- methylpiperazin- 1- yl)- 3- oxo- 2- oxabicyclo[2.2.1]heptane- 1- carboxamide
Smiles: CN1CCN(CC1)NC(=O)C12CCC(C2(C)C)(C(=O)O1)C

STK579018
Synonyms: 5- [(3,4- dichlorobenzyl)oxy]- 2- [4- (4- methoxyphenyl)- 3- methyl- 1H- pyrazol- 5- yl]phenol
Smiles: COc1ccc(cc1)c1c(C)n[nH]c1c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl

STK579023
Synonyms: N- (2- methoxyphenyl)- 3- (2- methyl- 1H- benzimidazol- 1- yl)propanamide
Smiles: COc1ccccc1NC(=O)CCn1c(C)nc2c1cccc2

STK849112
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- (4- fluorobenzyl)- 6,8- dimethyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Cc1cc(C)c2c(c1)c(=O)cc(o2)C(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)F

STK849113
Synonyms: 3- (2- chlorophenyl)- 5- methyl- 7- (pyrrolidin- 1- yl)pyrazolo[1,5- a]pyrimidine
Smiles: Cc1cc(N2CCCC2)n2c(n1)c(cn2)c1ccccc1Cl

STK579027
Synonyms: 2,2'- {[2- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 6- phenylpyrimidin- 4- yl]imino}diethanol
Smiles: OCCN(c1cc(nc(n1)n1nc(cc1C)C)c1ccccc1)CCO

STK579028
Synonyms: 5- (4- chlorophenyl)- 6- hydroxy- 1,3,8,8- tetramethyl- 5,7,8,9- tetrahydropyrimido[4,5- b]quinoline- 2,4(1H,3H)- dione
Smiles: Clc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(=O)n(C)c(=O)n2C)(C)C

STK579034
Synonyms: 2- [(5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- yl)amino]ethanol
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3NCCO

STK579041
Synonyms: 2- (2,4- dioxo- 1,3- thiazolidin- 5- yl)- N- [(2- hydroxyquinolin- 4- yl)methyl]- N- methylacetamide
Smiles: O=C1NC(=O)C(S1)CC(=O)N(Cc1cc(O)nc2c1cccc2)C

STK579044
Synonyms: 5- (4- methoxyphenyl)- 1,3- dimethyl- 10- phenyl- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: COc1ccc(cc1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1ccccc1

STK579045
Synonyms: 2- [(2- oxo- 2H- chromen- 7- yl)oxy]- N- [2- (4- sulfamoylphenyl)ethyl]acetamide
Smiles: O=C(COc1ccc2c(c1)oc(=O)cc2)NCCc1ccc(cc1)S(=O)(=O)N

STK579046
Synonyms: 7- chloro- 1- (4- hydroxy- 3- methoxyphenyl)- 2- [2- (4- methoxyphenyl)ethyl]- 6- methyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(c(c1)OC)O)c(=O)c1c(o2)cc(c(c1)Cl)C

STK579049
Synonyms: 7- (5- chloro- 2- methylphenyl)- 2- (thiophen- 2- yl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccc(c(c1)n1ncc2c1ncn1c2nc(n1)c1cccs1)C

STK579050
Synonyms: 5- [(3- chlorobenzyl)oxy]- 2- [5- phenyl- 6- (trifluoromethyl)pyrimidin- 4- yl]phenol
Smiles: Clc1cccc(c1)COc1ccc(c(c1)O)c1ncnc(c1c1ccccc1)C(F)(F)F

STL036521
Synonyms: 2- (4- fluorophenyl)- 5H- [1,2,4]triazolo[5,1- a]isoindole
Smiles: Fc1ccc(cc1)c1nn2c(n1)c1c(C2)cccc1

STK849119
Synonyms: 6,7- dimethoxy- 2- sulfanyl- 3- (thiophen- 2- ylmethyl)quinazolin- 4(3H)- one
Smiles: COc1cc2c(cc1OC)nc(n(c2=O)Cc1cccs1)S

STK579055
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (4- chlorophenyl)- 5- [2- (4- methoxyphenyl)ethyl]- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(cc1)Cl)c([nH]n2)c1cc(Cl)c(cc1O)C

STK849122
Synonyms: (5E)- 5- [2,5- dimethoxy- 4- (pyrrolidin- 1- yl)benzylidene]- 2- hydroxy- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: COc1cc(N2CCCC2)c(cc1/C=C\1/N=C(NC1=O)O)OC

STK579071
Synonyms: (5S)- 3- [4- (4- ethylpiperazin- 1- yl)phenyl]- 5- (propan- 2- yl)imidazolidine- 2,4- dione
Smiles: CCN1CCN(CC1)c1ccc(cc1)N1C(=O)N[C@H](C1=O)C(C)C

STK849124
Synonyms: 6- benzyl- 5- methyl- 2- (4- methylphenyl)pyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1ccc(cc1)c1nn2c(c1)nc(c(c2O)Cc1ccccc1)C

STK849125
Synonyms: 6- (2,3- dimethoxyphenyl)- N- (4- fluorophenyl)- 2- hydroxy- 4- methyl- 1,6- dihydropyrimidine- 5- carboxamide
Smiles: COc1cccc(c1OC)C1NC(=NC(=C1C(=O)Nc1ccc(cc1)F)C)O

STK579074
Synonyms: 3- [(5E)- 5- (4- fluorobenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- [2- (1H- indol- 3- yl)ethyl]propanamide
Smiles: O=C(CCN1C(=O)S/C(=C/c2ccc(cc2)F)/C1=O)NCCc1c[nH]c2c1cccc2

STK579075
Synonyms: 3- [(3a'S,6a'R)- 5'- (1,3- benzodioxol- 5- ylmethyl)- 5- fluoro- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]propanamide
Smiles: NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)C(=O)Nc1c2cc(F)cc1

STK579077
Synonyms: 2,8,8,10,10- pentamethyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nc2n(n1)cnc1c2c2CC(C)(C)NC(c2s1)(C)C

STK579079
Synonyms: 3- [(3a'S,6a'R)- 5'- (2- chlorobenzyl)- 5- fluoro- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]propanamide
Smiles: NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cc(F)cc1

STK579084
Synonyms: 7- (4- ethylpiperazin- 1- yl)- 3,5- diphenylpyrazolo[1,5- a]pyrimidine
Smiles: CCN1CCN(CC1)c1cc(nc2n1ncc2c1ccccc1)c1ccccc1

STK579085
Synonyms: (5,6- dimethoxy- 1H- indol- 2- yl)[4- (furan- 2- ylcarbonyl)piperazin- 1- yl]methanone
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)N1CCN(CC1)C(=O)c1ccco1

STK579089
Synonyms: 5,6- di(furan- 2- yl)- N- [3- (1H- imidazol- 1- yl)propyl]furo[2,3- d]pyrimidin- 4- amine
Smiles: C(Nc1ncnc2c1c(c1ccco1)c(o2)c1ccco1)CCn1cncc1

STK579091
Synonyms: 3- hydroxy- 2- {(2E)- 2- [(2- hydroxynaphthalen- 1- yl)methylidene]hydrazinyl}quinazolin- 4(3H)- one
Smiles: On1c(N/N=C/c2c(O)ccc3c2cccc3)nc2c(c1=O)cccc2

STK579093
Synonyms: 2- ({5- [(1S)- 1- amino- 2- phenylethyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)- N,N- dimethylacetamide
Smiles: N[C@H](c1nnc(o1)SCC(=O)N(C)C)Cc1ccccc1

STK849127
Synonyms: N- [(3Z)- 1- ethyl- 7- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]pyridine- 3- carboxamide
Smiles: CCn1[nH]/c(=N\C(=O)c2cccnc2)/c2c1nc1cc(C)ccc1c2

STK849129
Synonyms: 4- (3- chlorophenyl)- 3- (2- hydroxyphenyl)- 5- (2- phenylethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: Clc1cccc(c1)C1N(CCc2ccccc2)C(=O)c2c1c([nH]n2)c1ccccc1O

STK579096
Synonyms: N- (3- methoxyphenyl)- 5,6- dimethyl- 7- (pyridin- 3- yl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: COc1cccc(c1)Nc1ncnc2c1c(C)c(n2c1cccnc1)C

STK579101
Synonyms: 2- chloro- N'- {(1E)- 1- [4- hydroxy- 2,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 5(2H)- ylidene]propyl}benzohydrazide
Smiles: C=CCN1C(=O)N=C(/C(=C(\NNC(=O)c2ccccc2Cl)/CC)/C1=O)O

STK849131
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(2- fluoro- 5- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(C)ccc1F)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK579105
Synonyms: N- [(4- butylphenyl)carbamoyl]- D- phenylalanine
Smiles: CCCCc1ccc(cc1)NC(=O)N[C@@H](C(=O)O)Cc1ccccc1

STK579107
Synonyms: 1- {N- [(5- chloro- 1- methyl- 1H- indol- 2- yl)carbonyl]- L- leucyl}piperidine- 4- carboxylicacid
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)O)NC(=O)c1cc2c(n1C)ccc(c2)Cl)C

STK849132
Synonyms: 3- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 5- phenyl- 4H- 1,2,4- triazol- 4- amine
Smiles: CC(=C)CSc1nnc(n1N)c1ccccc1

STK849133
Synonyms: 2- methoxy- N- [(2Z)- 5- [(2- methoxy- 5- nitrobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: COc1ccc(cc1CSc1n[nH]/c(=N/C(=O)c2ccccc2OC)/s1)[N+](=O)[O-]

STK579116
Synonyms: 2- (2- chlorophenoxy)- 3- {(Z)- [3- (3- methoxypropyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COCCCN1C(=S)S/C(=C\c2c(Oc3ccccc3Cl)nc3n(c2=O)cccc3)/C1=O

STK579119
Synonyms: N- [(2E)- 3- (3- chlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 3- phenylpropanamide
Smiles: O=C(/N=C\1/SC2C(N1c1cccc(c1)Cl)CS(=O)(=O)C2)CCc1ccccc1

STK579121
Synonyms: (5Z)- 3- (4- fluorobenzyl)- 5- [(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CC1Oc2c(C1)cc(cc2)/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)F

STK579122
Synonyms: N- [4- (4- methoxyphenyl)- 6- methyl- 2- (4- methylphenyl)- 5- oxo- 2,5- dihydropyridazin- 3- yl]furan- 2- carboxamide
Smiles: COc1ccc(cc1)c1c(NC(=O)c2ccco2)n(nc(c1=O)C)c1ccc(cc1)C

STK579123
Synonyms: 2- {[4- (4- chlorophenyl)- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 3- yl]methyl}phthalazin- 1(2H)- one
Smiles: Clc1ccc(cc1)n1c(=S)[nH]nc1Cn1ncc2c(c1=O)cccc2

STK579125
Synonyms: N- {4- [4- (phenylcarbonyl)piperazin- 1- yl]phenyl}- 4,5,6,7- tetrahydro- 2H- indazole- 3- carboxamide
Smiles: O=C(c1[nH]nc2c1CCCC2)Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccccc1

STK579126
Synonyms: N- [(2Z)- 3- (4- bromophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]tetrahydrofuran- 2- carboxamide
Smiles: Brc1ccc(cc1)N1/C(=N/C(=O)C2CCCO2)/SC2C1CS(=O)(=O)C2

STK849135
Synonyms: 4- {[(E)- (3- ethoxy- 2- hydroxyphenyl)methylidene]amino}- 5- (2- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1O)/C=N/n1c(=S)[nH]nc1c1ccccc1C

STK849136
Synonyms: methyl{2- [(2- methoxybenzyl)amino]- 5- methyl- 7- oxo- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl}acetate
Smiles: COC(=O)Cc1c(C)nc2n(c1=O)nc([nH]2)NCc1ccccc1OC

STK579131
Synonyms: 1',4,4- trimethyl- 6'- nitro- 2'- phenyl- 1',4'- dihydro- 2H,2'H,6H- spiro[cyclohexane- 1,3'- quinoline]- 2,6- dione
Smiles: O=C1CC(C)(C)CC(=O)C21Cc1cc(ccc1N(C2c1ccccc1)C)[N+](=O)[O-]

STK579132
Synonyms: 5,6- dimethoxy- N- (2- methoxyphenyl)- 1H- indole- 2- carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)Nc1ccccc1OC

STK579134
Synonyms: (3aR,6aS)- 5- (3- chloro- 4- fluorophenyl)- 3- (3,4- dimethoxyphenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: COc1cc(ccc1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(c(c1)Cl)F

STK849137
Synonyms: methyl4- [3,9- dioxo- 2- (pyridin- 3- ylmethyl)- 1,2,3,9- tetrahydrochromeno[2,3- c]pyrrol- 1- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK849139
Synonyms: 8- (2- chloro- 6- fluorophenyl)- 3- (4- methoxyphenyl)- 6- oxo- 3,4,7,8- tetrahydro- 2H,6H- pyrido[2,1- b][1,3,5]thiadiazine- 9- carbonitrile
Smiles: COc1ccc(cc1)N1CSC2=C(C#N)C(CC(=O)N2C1)c1c(F)cccc1Cl

STL036522
Synonyms: 4- (2- methoxyphenyl)- 3- phenyl- 2,4,5,7- tetrahydro- 6H- pyrazolo[3,4- b]pyridin- 6- one
Smiles: COc1ccccc1C1CC(=O)Nc2c1c([nH]n2)c1ccccc1

STK579144
Synonyms: (2Z)- 6- [(2- chlorobenzyl)oxy]- 2- (2H- chromen- 3- ylmethylidene)- 1- benzofuran- 3(2H)- one
Smiles: O=C1/C(=C/C2=Cc3c(OC2)cccc3)/Oc2c1ccc(c2)OCc1ccccc1Cl

STK579146
Synonyms: 4- {[4- (4- methoxyphenyl)piperazin- 1- yl]methyl}- 2H- benzo[h]chromen- 2- one
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1cc(=O)oc2c1ccc1c2cccc1

STK579148
Synonyms: 2- [(5,6- dimethylfuro[2,3- d]pyrimidin- 4- yl)amino]ethanol
Smiles: Cc1c(C)oc2c1c(NCCO)ncn2

STL036523
Synonyms: 4- (1,3- benzothiazol- 2- yl)- N- phenylpiperazine- 1- carboxamide
Smiles: O=C(N1CCN(CC1)c1nc2c(s1)cccc2)Nc1ccccc1

STK579151
Synonyms: 3- (2- hydroxy- 3,5- dimethylphenyl)- 4- (3- methoxyphenyl)- 5- (pyridin- 3- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1cccc(c1)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C

STK579152
Synonyms: 5- bromo- N- [(2Z)- 4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2(3H)- ylidene]furan- 2- carboxamide
Smiles: COc1cc(ccc1OC)c1cs/c(=N\C(=O)c2ccc(o2)Br)/[nH]1

STK579156
Synonyms: 3- (2- hydroxy- 3,5- dimethylphenyl)- 5- (2- hydroxyethyl)- 4- (4- methoxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCN1C(=O)c2c(C1c1ccc(cc1)OC)c([nH]n2)c1cc(C)cc(c1O)C

STK849145
Synonyms: 5- [(4- chlorobenzyl)oxy]- 2- [4- (4- methoxyphenoxy)- 1H- pyrazol- 3- yl]phenol
Smiles: COc1ccc(cc1)Oc1c[nH]nc1c1ccc(cc1O)OCc1ccc(cc1)Cl

STK849147
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 5- methyl- 3- phenyl- 6- (prop- 2- en- 1- yl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: C=CCc1c(C)nc2n(c1NCCc1ccc(c(c1)OC)OC)ncc2c1ccccc1

STK579160
Synonyms: 7- (1H- benzimidazol- 1- yl)- 2- methyl- 3- phenyl- 5- propylpyrazolo[1,5- a]pyrimidine
Smiles: CCCc1nc2c(c3ccccc3)c(nn2c(c1)n1cnc2c1cccc2)C

STK579162
Synonyms: 11- (4- fluorophenyl)- 3- methyl- 2,3,4,11- tetrahydrodibenzo[b,e][1,4]thiazepin- 1- ol
Smiles: CC1CC(=C2C(=Nc3ccccc3SC2c2ccc(cc2)F)C1)O

STK579165
Synonyms: 1- (3- bromo- 4- hydroxy- 5- methoxyphenyl)- 7- chloro- 2- (2- methoxyethyl)- 6- methyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COCCN1C(=O)c2c(C1c1cc(Br)c(c(c1)OC)O)c(=O)c1c(o2)cc(c(c1)Cl)C

STK849148
Synonyms: 1- (4- fluorophenyl)- 2,7- dimethyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc(cc1)C1N(C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK579167
Synonyms: N- [(3Z)- 1- ethyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 2,1,3- benzoxadiazole- 4- sulfonamide
Smiles: CCn1[nH]/c(=N\S(=O)(=O)c2cccc3c2non3)/c2c1nc1ccccc1c2

STK579169
Synonyms: 7- chloro- 6- methyl- 1- phenyl- 2- (pyridin- 3- ylmethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: O=C1N(Cc2cccnc2)C(c2c1oc1cc(C)c(cc1c2=O)Cl)c1ccccc1

STK579171
Synonyms: 2- [(2,3- dichlorophenyl)amino]- 8- methyl- 4- [4- (propan- 2- yl)phenyl]- 4H- pyrimido[1,2- a][1,3,5]triazin- 6- ol
Smiles: Cc1cc(O)n2c(=NC(=NC2c2ccc(cc2)C(C)C)Nc2cccc(c2Cl)Cl)n1

STK579172
Synonyms: N- (1- imino- 1,3- dihydro- 2H- isoindol- 2- yl)- 4,7,7- trimethyl- 3- oxo- 2- oxabicyclo[2.2.1]heptane- 1- carboxamide
Smiles: N=C1N(Cc2c1cccc2)NC(=O)C12CCC(C2(C)C)(C(=O)O1)C

STK579173
Synonyms: (1R,2S)- 2- [benzyl(butyl)carbamoyl]cyclohexanecarboxylicacid
Smiles: CCCCN(C(=O)[C@H]1CCCC[C@H]1C(=O)O)Cc1ccccc1

STK579174
Synonyms: 6- chloro- 4- {[4- (ethoxycarbonyl)piperazin- 1- ium- 1- yl]methyl}- 2- oxo- 2H- chromen- 7- olate
Smiles: CCOC(=O)N1CC[NH+](CC1)Cc1cc(=O)oc2c1cc(Cl)c(c2)[O-]

STK579175
Synonyms: 4- amino- N- (1,3- benzodioxol- 5- ylmethyl)- 3- phenyl- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: O=C(c1sc(=S)n(c1N)c1ccccc1)NCc1ccc2c(c1)OCO2

STK579178
Synonyms: 3- (2,5- dimethylphenyl)- 6- hydroxy- 1',6'- dimethyl- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4(3H)- dione
Smiles: Cc1ccc2c(c1)CC1(CN2C)C(=NC(=O)N(C1=O)c1cc(C)ccc1C)O

STK579179
Synonyms: 4- methoxy- N- [4- (4- methylphenyl)- 1,2,5- oxadiazol- 3- yl]benzamide
Smiles: COc1ccc(cc1)C(=O)Nc1nonc1c1ccc(cc1)C

STK849151
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 2- oxo- 2H- chromen- 7- ylmorpholine- 4- carboxylate
Smiles: O=C(N1CCOCC1)Oc1ccc2c(c1)oc(=O)c(c2)c1nc2c(s1)cccc2