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

Systemtic Name: 4-[(1-aminocarbonylpiperidin-4-yl)amino]-1-ethyl-N-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-benzyl-4-[(1-carbamoyl-4-piperidyl)amino]-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-[(1-carbamoyl-4-piperidinyl)amino]-1-ethyl-N-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-benzyl-4-[(1-carbamoylpiperidin-4-yl)amino]-1-ethylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-benzyl-4-[(1-carbamoyl-4-piperidyl)amino]-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C22H27N7O2 MolecularWeight: 421.49548

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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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N7O2/c1-2-29-20-17(14-26-29)19(27-16-8-10-28(11-9-16)22(23)31)18(13-24-20)21(30)25-12-15-6-4-3-5-7-15/h3-7,13-14,16H,2,8-12H2,1H3,(H2,23,31)(H,24,27)(H,25,30)