1,3-dimethyl-6-phenyl-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 1,3-dimethyl-6-phenyl-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 1,3-dimethyl-6-phenyl-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: 1,3-dimethyl-N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1,3-dimethyl-6-phenyl-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 1,3-dimethyl-6-phenyl-N-[4-(pyrrolidine-1-carbonyl)benzyl]pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)NCC4=CC=C(C=C4)C(=O)N5CCCC5)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)NCC4=CC=C(C=C4)C(=O)N5CCCC5)C

InChI

InChI=1S/C27H27N5O2/c1-18-24-22(16-23(20-8-4-3-5-9-20)29-25(24)31(2)30-18)26(33)28-17-19-10-12-21(13-11-19)27(34)32-14-6-7-15-32/h3-5,8-13,16H,6-7,14-15,17H2,1-2H3,(H,28,33)