(3-methylphenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (3-methylphenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(m-tolyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(3-methylphenyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(3-methylphenyl)methanone Traditional Name: (4-besylpiperazino)-(m-tolyl)methanone Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3S/c1-15-6-5-7-16(14-15)18(21)19-10-12-20(13-11-19)24(22,23)17-8-3-2-4-9-17/h2-9,14H,10-13H2,1H3