N-cyclopropyl-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenyl-ethanamide

Systemtic Name: N-cyclopropyl-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenyl-ethanamide Openeye Name: N-cyclopropyl-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenyl-acetamide CAS Name: N-cyclopropyl-2-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-2-phenylacetamide IUPAC Name: N-cyclopropyl-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenylacetamide Traditional Name: N-cyclopropyl-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]-2-phenyl-acetamide Formula: C21H25N7O MolecularWeight: 391.4695

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(C4=CC=CC=C4)C(=O)NC5CC5

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(C4=CC=CC=C4)C(=O)NC5CC5

InChI

InChI=1S/C21H25N7O/c1-26-19-17(13-24-26)20(23-14-22-19)28-11-9-27(10-12-28)18(15-5-3-2-4-6-15)21(29)25-16-7-8-16/h2-6,13-14,16,18H,7-12H2,1H3,(H,25,29)