2-methyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 2-methyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 2-methyl-4-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrimidine CAS Name: 2-methyl-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 2-methyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 2-methyl-4-(4-tosylpiperazino)pyrimidine Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O2S/c1-13-3-5-15(6-4-13)23(21,22)20-11-9-19(10-12-20)16-7-8-17-14(2)18-16/h3-8H,9-12H2,1-2H3