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

Systemtic Name: 2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-N-(2-phenylpropyl)ethanamide Openeye Name: 2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-N-(2-phenylpropyl)acetamide CAS Name: 2-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-N-(2-phenylpropyl)acetamide IUPAC Name: 2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-N-(2-phenylpropyl)acetamide Traditional Name: 2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]-N-(2-phenylpropyl)acetamide Formula: C21H27N7O MolecularWeight: 393.48538

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CN1CCN(CC1)C2=NC=NC3=C2C=NN3C)C4=CC=CC=C4

Isomeric SMILES

CC(CNC(=O)CN1CCN(CC1)C2=NC=NC3=C2C=NN3C)C4=CC=CC=C4

InChI

InChI=1S/C21H27N7O/c1-16(17-6-4-3-5-7-17)12-22-19(29)14-27-8-10-28(11-9-27)21-18-13-25-26(2)20(18)23-15-24-21/h3-7,13,15-16H,8-12,14H2,1-2H3,(H,22,29)