2-[5-[2-[2,3-bis(fluoranyl)phenyl]ethyl]-2-methyl-7-oxidanylidene-pyrazolo[4,3-b]pyridin-4-yl]-N-(1-ethylpiperidin-4-yl)-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]ethanamide; 2,3-bis(oxidanyl)butanedioic acid

Systemtic Name: 2-[5-[2-[2,3-bis(fluoranyl)phenyl]ethyl]-2-methyl-7-oxidanylidene-pyrazolo[4,3-b]pyridin-4-yl]-N-(1-ethylpiperidin-4-yl)-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]ethanamide; 2,3-bis(oxidanyl)butanedioic acid Openeye Name: 2-[5-[2-(2,3-difluorophenyl)ethyl]-2-methyl-7-oxo-pyrazolo[4,3-b]pyridin-4-yl]-N-(1-ethyl-4-piperidyl)-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]acetamide; 2,3-dihydroxybutanedioic acid CAS Name: 2-[5-[2-(2,3-difluorophenyl)ethyl]-2-methyl-7-oxo-4-pyrazolo[4,3-b]pyridinyl]-N-(1-ethyl-4-piperidinyl)-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]acetamide; 2,3-dihydroxybutanedioic acid IUPAC Name: 2-[5-[2-(2,3-difluorophenyl)ethyl]-2-methyl-7-oxopyrazolo[4,3-b]pyridin-4-yl]-N-(1-ethylpiperidin-4-yl)-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]acetamide; 2,3-dihydroxybutanedioic acid Traditional Name: 2-[5-[2-(2,3-difluorophenyl)ethyl]-7-keto-2-methyl-pyrazolo[4,3-b]pyridin-4-yl]-N-(1-ethyl-4-piperidyl)-N-[4-[4-(trifluoromethyl)phenyl]benzyl]acetamide; tartaric acid Formula: C42H44F5N5O8 MolecularWeight: 841.819476

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)N(CC2=CC=C(C=C2)C3=CC=C(C=C3)C(F)(F)F)C(=O)CN4C(=CC(=O)C5=NN(C=C54)C)CCC6=C(C(=CC=C6)F)F.C(C(C(=O)O)O)(C(=O)O)O

Isomeric SMILES

CCN1CCC(CC1)N(CC2=CC=C(C=C2)C3=CC=C(C=C3)C(F)(F)F)C(=O)CN4C(=CC(=O)C5=NN(C=C54)C)CCC6=C(C(=CC=C6)F)F.C(C(C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C38H38F5N5O2.C4H6O6/c1-3-46-19-17-30(18-20-46)48(22-25-7-9-26(10-8-25)27-11-14-29(15-12-27)38(41,42)43)35(50)24-47-31(16-13-28-5-4-6-32(39)36(28)40)21-34(49)37-33(47)23-45(2)44-37;5-1(3(7)8)2(6)4(9)10/h4-12,14-15,21,23,30H,3,13,16-20,22,24H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)