2-(3-methylphenyl)-1-(4-methylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(3-methylphenyl)-1-(4-methylsulfonylpiperazin-1-yl)ethanone Openeye Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-(m-tolyl)ethanone CAS Name: 2-(3-methylphenyl)-1-(4-methylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-(3-methylphenyl)-1-(4-methylsulfonylpiperazin-1-yl)ethanone Traditional Name: 1-(4-mesylpiperazino)-2-(m-tolyl)ethanone Formula: C14H20N2O3S MolecularWeight: 296.3852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O3S/c1-12-4-3-5-13(10-12)11-14(17)15-6-8-16(9-7-15)20(2,18)19/h3-5,10H,6-9,11H2,1-2H3