1-methyl-N-phenyl-6-[4-(phenylmethyl)piperazin-1-yl]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-methyl-N-phenyl-6-[4-(phenylmethyl)piperazin-1-yl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 6-(4-benzylpiperazin-1-yl)-1-methyl-N-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-methyl-N-phenyl-6-[4-(phenylmethyl)-1-piperazinyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 6-(4-benzylpiperazin-1-yl)-1-methyl-N-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [6-(4-benzylpiperazino)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-phenyl-amine Formula: C23H25N7 MolecularWeight: 399.4915

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)CC4=CC=CC=C4)NC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)CC4=CC=CC=C4)NC5=CC=CC=C5

InChI

InChI=1S/C23H25N7/c1-28-22-20(16-24-28)21(25-19-10-6-3-7-11-19)26-23(27-22)30-14-12-29(13-15-30)17-18-8-4-2-5-9-18/h2-11,16H,12-15,17H2,1H3,(H,25,26,27)