N-(4-methylphenyl)-1-phenyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(4-methylphenyl)-1-phenyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-phenyl-6-(4-phenylpiperazin-1-yl)-N-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(4-methylphenyl)-1-phenyl-6-(4-phenyl-1-piperazinyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(4-methylphenyl)-1-phenyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-phenyl-6-(4-phenylpiperazino)pyrazolo[3,4-d]pyrimidin-4-yl]-(p-tolyl)amine Formula: C28H27N7 MolecularWeight: 461.56088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C28H27N7/c1-21-12-14-22(15-13-21)30-26-25-20-29-35(24-10-6-3-7-11-24)27(25)32-28(31-26)34-18-16-33(17-19-34)23-8-4-2-5-9-23/h2-15,20H,16-19H2,1H3,(H,30,31,32)