6-methyl-N-(4-methylphenyl)-2-[4-(4-phenylphenyl)sulfonylpiperazin-1-yl]pyrimidin-4-amine

Systemtic Name: 6-methyl-N-(4-methylphenyl)-2-[4-(4-phenylphenyl)sulfonylpiperazin-1-yl]pyrimidin-4-amine Openeye Name: 6-methyl-2-[4-(4-phenylphenyl)sulfonylpiperazin-1-yl]-N-(p-tolyl)pyrimidin-4-amine CAS Name: 6-methyl-N-(4-methylphenyl)-2-[4-(4-phenylphenyl)sulfonyl-1-piperazinyl]-4-pyrimidinamine IUPAC Name: 6-methyl-N-(4-methylphenyl)-2-[4-(4-phenylphenyl)sulfonylpiperazin-1-yl]pyrimidin-4-amine Traditional Name: [6-methyl-2-[4-(4-phenylphenyl)sulfonylpiperazino]pyrimidin-4-yl]-(p-tolyl)amine Formula: C28H29N5O2S MolecularWeight: 499.62716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=C2)C)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=C2)C)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H29N5O2S/c1-21-8-12-25(13-9-21)30-27-20-22(2)29-28(31-27)32-16-18-33(19-17-32)36(34,35)26-14-10-24(11-15-26)23-6-4-3-5-7-23/h3-15,20H,16-19H2,1-2H3,(H,29,30,31)