[4-(2-methylphenyl)piperazin-1-yl]-[3-(methylsulfonylmethyl)phenyl]methanone

Systemtic Name: [4-(2-methylphenyl)piperazin-1-yl]-[3-(methylsulfonylmethyl)phenyl]methanone Openeye Name: [3-(methylsulfonylmethyl)phenyl]-[4-(o-tolyl)piperazin-1-yl]methanone CAS Name: [4-(2-methylphenyl)-1-piperazinyl]-[3-(methylsulfonylmethyl)phenyl]methanone IUPAC Name: [4-(2-methylphenyl)piperazin-1-yl]-[3-(methylsulfonylmethyl)phenyl]methanone Traditional Name: [3-(mesylmethyl)phenyl]-[4-(o-tolyl)piperazino]methanone Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=CC=C3)CS(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=CC=C3)CS(=O)(=O)C

InChI

InChI=1S/C20H24N2O3S/c1-16-6-3-4-9-19(16)21-10-12-22(13-11-21)20(23)18-8-5-7-17(14-18)15-26(2,24)25/h3-9,14H,10-13,15H2,1-2H3