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

Systemtic Name: N-(4-ethoxyphenyl)-1-phenyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(4-ethoxyphenyl)-1-phenyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(4-ethoxyphenyl)-1-phenyl-6-(4-phenyl-1-piperazinyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(4-ethoxyphenyl)-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-phenetyl-amine Formula: C29H29N7O MolecularWeight: 491.58686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C29H29N7O/c1-2-37-25-15-13-22(14-16-25)31-27-26-21-30-36(24-11-7-4-8-12-24)28(26)33-29(32-27)35-19-17-34(18-20-35)23-9-5-3-6-10-23/h3-16,21H,2,17-20H2,1H3,(H,31,32,33)