2,5-dimethyl-N-[2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: 2,5-dimethyl-N-[2-[4-(o-tolyl)piperazin-1-yl]-2-oxo-ethyl]benzenesulfonamide CAS Name: 2,5-dimethyl-N-[2-[4-(2-methylphenyl)-1-piperazinyl]-2-oxoethyl]benzenesulfonamide IUPAC Name: 2,5-dimethyl-N-[2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl]benzenesulfonamide Traditional Name: N-[2-keto-2-[4-(o-tolyl)piperazino]ethyl]-2,5-dimethyl-benzenesulfonamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCC(=O)N2CCN(CC2)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCC(=O)N2CCN(CC2)C3=CC=CC=C3C

InChI

InChI=1S/C21H27N3O3S/c1-16-8-9-18(3)20(14-16)28(26,27)22-15-21(25)24-12-10-23(11-13-24)19-7-5-4-6-17(19)2/h4-9,14,22H,10-13,15H2,1-3H3