2-(2-methoxy-5-methyl-phenyl)-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(2-methoxy-5-methyl-phenyl)-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(2-methoxy-5-methyl-phenyl)ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(2-methoxy-5-methylphenyl)ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(2-methoxy-5-methylphenyl)ethanone Traditional Name: 1-(4-besylpiperazino)-2-(2-methoxy-5-methyl-phenyl)ethanone Formula: C20H24N2O4S MolecularWeight: 388.48056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O4S/c1-16-8-9-19(26-2)17(14-16)15-20(23)21-10-12-22(13-11-21)27(24,25)18-6-4-3-5-7-18/h3-9,14H,10-13,15H2,1-2H3