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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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