4-[(1-aminocarbonylpiperidin-4-yl)amino]-1-ethyl-N-[(3-phenylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 4-[(1-aminocarbonylpiperidin-4-yl)amino]-1-ethyl-N-[(3-phenylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-[(1-carbamoyl-4-piperidyl)amino]-1-ethyl-N-[(3-phenylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-[(1-carbamoyl-4-piperidinyl)amino]-1-ethyl-N-[(3-phenylphenyl)methyl]-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 4-[(1-carbamoylpiperidin-4-yl)amino]-1-ethyl-N-[(3-phenylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-[(1-carbamoyl-4-piperidyl)amino]-1-ethyl-N-(3-phenylbenzyl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C28H31N7O2 MolecularWeight: 497.59144

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NC3CCN(CC3)C(=O)N)C(=O)NCC4=CC=CC(=C4)C5=CC=CC=C5

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)NC3CCN(CC3)C(=O)N)C(=O)NCC4=CC=CC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H31N7O2/c1-2-35-26-23(18-32-35)25(33-22-11-13-34(14-12-22)28(29)37)24(17-30-26)27(36)31-16-19-7-6-10-21(15-19)20-8-4-3-5-9-20/h3-10,15,17-18,22H,2,11-14,16H2,1H3,(H2,29,37)(H,30,33)(H,31,36)