4-methyl-2-(3-methylphenyl)-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-5-(phenylmethyl)pyrimidine

Systemtic Name: 4-methyl-2-(3-methylphenyl)-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-5-(phenylmethyl)pyrimidine Openeye Name: 5-benzyl-4-methyl-2-(m-tolyl)-6-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrimidine CAS Name: 4-methyl-2-(3-methylphenyl)-6-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-5-(phenylmethyl)pyrimidine IUPAC Name: 5-benzyl-4-methyl-2-(3-methylphenyl)-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 5-benzyl-4-methyl-2-(m-tolyl)-6-(4-tosylpiperazino)pyrimidine Formula: C30H32N4O2S MolecularWeight: 512.66568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=CC=C4)C)C5=CC(=CC=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=CC=C4)C)C5=CC(=CC=C5)C

InChI

InChI=1S/C30H32N4O2S/c1-22-12-14-27(15-13-22)37(35,36)34-18-16-33(17-19-34)30-28(21-25-9-5-4-6-10-25)24(3)31-29(32-30)26-11-7-8-23(2)20-26/h4-15,20H,16-19,21H2,1-3H3