3,4-dimethyl-N-[4-[4-(2-methylphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]benzenesulfonamide

Systemtic Name: 3,4-dimethyl-N-[4-[4-(2-methylphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]benzenesulfonamide Openeye Name: 3,4-dimethyl-N-[4-[4-(o-tolyl)piperazin-1-yl]-4-oxo-butyl]benzenesulfonamide CAS Name: 3,4-dimethyl-N-[4-[4-(2-methylphenyl)-1-piperazinyl]-4-oxobutyl]benzenesulfonamide IUPAC Name: 3,4-dimethyl-N-[4-[4-(2-methylphenyl)piperazin-1-yl]-4-oxobutyl]benzenesulfonamide Traditional Name: N-[4-keto-4-[4-(o-tolyl)piperazino]butyl]-3,4-dimethyl-benzenesulfonamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O3S/c1-18-10-11-21(17-20(18)3)30(28,29)24-12-6-9-23(27)26-15-13-25(14-16-26)22-8-5-4-7-19(22)2/h4-5,7-8,10-11,17,24H,6,9,12-16H2,1-3H3