2-methyl-N-(4-methylphenyl)-6-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidin-4-amine

Systemtic Name: 2-methyl-N-(4-methylphenyl)-6-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidin-4-amine Openeye Name: 6-[4-(benzenesulfonyl)piperazin-1-yl]-2-methyl-N-(p-tolyl)pyrimidin-4-amine CAS Name: 6-[4-(benzenesulfonyl)-1-piperazinyl]-2-methyl-N-(4-methylphenyl)-4-pyrimidinamine IUPAC Name: 6-[4-(benzenesulfonyl)piperazin-1-yl]-2-methyl-N-(4-methylphenyl)pyrimidin-4-amine Traditional Name: [6-(4-besylpiperazino)-2-methyl-pyrimidin-4-yl]-(p-tolyl)amine Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N5O2S/c1-17-8-10-19(11-9-17)25-21-16-22(24-18(2)23-21)26-12-14-27(15-13-26)30(28,29)20-6-4-3-5-7-20/h3-11,16H,12-15H2,1-2H3,(H,23,24,25)