4-[3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[3-methyl-1-phenyl-6-(p-tolylmethyl)pyrazolo[3,4-d]pyrimidin-4-yl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[3-methyl-6-[(4-methylphenyl)methyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[3-methyl-6-(4-methylbenzyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-phenyl-piperazine-1-carboxamide Formula: C31H31N7O MolecularWeight: 517.62414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NC3=C(C(=NN3C4=CC=CC=C4)C)C(=N2)N5CCN(CC5)C(=O)NC6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NC3=C(C(=NN3C4=CC=CC=C4)C)C(=N2)N5CCN(CC5)C(=O)NC6=CC=CC=C6

InChI

InChI=1S/C31H31N7O/c1-22-13-15-24(16-14-22)21-27-33-29(28-23(2)35-38(30(28)34-27)26-11-7-4-8-12-26)36-17-19-37(20-18-36)31(39)32-25-9-5-3-6-10-25/h3-16H,17-21H2,1-2H3,(H,32,39)