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

Systemtic Name: N-(4-methylphenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenyl-ethanamide Openeye Name: 2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenyl-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-2-phenylacetamide IUPAC Name: N-(4-methylphenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenylacetamide Traditional Name: 2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]-2-phenyl-N-(p-tolyl)acetamide Formula: C25H27N7O MolecularWeight: 441.52818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)N3CCN(CC3)C4=NC=NC5=C4C=NN5C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)N3CCN(CC3)C4=NC=NC5=C4C=NN5C

InChI

InChI=1S/C25H27N7O/c1-18-8-10-20(11-9-18)29-25(33)22(19-6-4-3-5-7-19)31-12-14-32(15-13-31)24-21-16-28-30(2)23(21)26-17-27-24/h3-11,16-17,22H,12-15H2,1-2H3,(H,29,33)