1-[3-(3-aminophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-3-carboxamide

Systemtic Name: 1-[3-(3-aminophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-3-carboxamide Openeye Name: 1-[3-(3-aminophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-3-carboxamide CAS Name: 1-[3-(3-aminophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-piperidinecarboxamide IUPAC Name: 1-[3-(3-aminophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-3-carboxamide Traditional Name: 1-[3-(3-aminophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]nipecotamide Formula: C17H19N7O MolecularWeight: 337.37906

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=NC3=NNC(=C32)C4=CC(=CC=C4)N)C(=O)N

Isomeric SMILES

C1CC(CN(C1)C2=NC=NC3=NNC(=C32)C4=CC(=CC=C4)N)C(=O)N

InChI

InChI=1S/C17H19N7O/c18-12-5-1-3-10(7-12)14-13-16(23-22-14)20-9-21-17(13)24-6-2-4-11(8-24)15(19)25/h1,3,5,7,9,11H,2,4,6,8,18H2,(H2,19,25)(H,20,21,22,23)