4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-phenyl-6-(phenylmethyl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-phenyl-6-(phenylmethyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 6-benzyl-1-phenyl-4-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrazolo[3,4-d]pyrimidine CAS Name: 4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-phenyl-6-(phenylmethyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 6-benzyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 6-benzyl-1-phenyl-4-(4-tosylpiperazino)pyrazolo[3,4-d]pyrimidine Formula: C29H28N6O2S MolecularWeight: 524.63662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC4=C3C=NN4C5=CC=CC=C5)CC6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC4=C3C=NN4C5=CC=CC=C5)CC6=CC=CC=C6

InChI

InChI=1S/C29H28N6O2S/c1-22-12-14-25(15-13-22)38(36,37)34-18-16-33(17-19-34)28-26-21-30-35(24-10-6-3-7-11-24)29(26)32-27(31-28)20-23-8-4-2-5-9-23/h2-15,21H,16-20H2,1H3