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

Systemtic Name: N-(4-chlorophenyl)-6-(4-methylpiperazin-1-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(4-chlorophenyl)-6-(4-methylpiperazin-1-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(4-chlorophenyl)-6-(4-methyl-1-piperazinyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(4-chlorophenyl)-6-(4-methylpiperazin-1-yl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (4-chlorophenyl)-[6-(4-methylpiperazino)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C22H22ClN7 MolecularWeight: 419.90998

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=C(C=NN3C4=CC=CC=C4)C(=N2)NC5=CC=C(C=C5)Cl

Isomeric SMILES

CN1CCN(CC1)C2=NC3=C(C=NN3C4=CC=CC=C4)C(=N2)NC5=CC=C(C=C5)Cl

InChI

InChI=1S/C22H22ClN7/c1-28-11-13-29(14-12-28)22-26-20(25-17-9-7-16(23)8-10-17)19-15-24-30(21(19)27-22)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3,(H,25,26,27)