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

Systemtic Name: N-(3-methoxyphenyl)-1-phenyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-methoxyphenyl)-1-phenyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3-methoxyphenyl)-1-phenyl-6-(4-phenyl-1-piperazinyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(3-methoxyphenyl)-1-phenyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3-methoxyphenyl)-[1-phenyl-6-(4-phenylpiperazino)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C28H27N7O MolecularWeight: 477.56028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C28H27N7O/c1-36-24-14-8-9-21(19-24)30-26-25-20-29-35(23-12-6-3-7-13-23)27(25)32-28(31-26)34-17-15-33(16-18-34)22-10-4-2-5-11-22/h2-14,19-20H,15-18H2,1H3,(H,30,31,32)