N-(2-methoxy-5-methyl-phenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenyl-ethanamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenyl-ethanamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenyl-acetamide CAS Name: N-(2-methoxy-5-methylphenyl)-2-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-2-phenylacetamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenylacetamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]-2-phenyl-acetamide Formula: C26H29N7O2 MolecularWeight: 471.55416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N7O2/c1-18-9-10-22(35-3)21(15-18)30-26(34)23(19-7-5-4-6-8-19)32-11-13-33(14-12-32)25-20-16-29-31(2)24(20)27-17-28-25/h4-10,15-17,23H,11-14H2,1-3H3,(H,30,34)