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

Systemtic Name: 4-methyl-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-phenyl-5-(phenylmethyl)pyrimidine Openeye Name: 5-benzyl-4-methyl-2-phenyl-6-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrimidine CAS Name: 4-methyl-6-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-phenyl-5-(phenylmethyl)pyrimidine IUPAC Name: 5-benzyl-4-methyl-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-phenylpyrimidine Traditional Name: 5-benzyl-4-methyl-2-phenyl-6-(4-tosylpiperazino)pyrimidine Formula: C29H30N4O2S MolecularWeight: 498.6391

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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

Isomeric SMILES

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

InChI

InChI=1S/C29H30N4O2S/c1-22-13-15-26(16-14-22)36(34,35)33-19-17-32(18-20-33)29-27(21-24-9-5-3-6-10-24)23(2)30-28(31-29)25-11-7-4-8-12-25/h3-16H,17-21H2,1-2H3