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

Systemtic Name: N-(4-methoxyphenyl)-1-methyl-6-[4-(phenylmethyl)piperazin-1-yl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 6-(4-benzylpiperazin-1-yl)-N-(4-methoxyphenyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(4-methoxyphenyl)-1-methyl-6-[4-(phenylmethyl)-1-piperazinyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 6-(4-benzylpiperazin-1-yl)-N-(4-methoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [6-(4-benzylpiperazino)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-(4-methoxyphenyl)amine Formula: C24H27N7O MolecularWeight: 429.51748

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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=C(C=C5)OC

Isomeric SMILES

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

InChI

InChI=1S/C24H27N7O/c1-29-23-21(16-25-29)22(26-19-8-10-20(32-2)11-9-19)27-24(28-23)31-14-12-30(13-15-31)17-18-6-4-3-5-7-18/h3-11,16H,12-15,17H2,1-2H3,(H,26,27,28)