3,4-dimethoxy-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]benzenesulfonamide Openeye Name: 3,4-dimethoxy-N-[4-[4-(m-tolyl)piperazin-1-yl]butyl]benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[4-[4-(3-methylphenyl)-1-piperazinyl]butyl]benzenesulfonamide IUPAC Name: 3,4-dimethoxy-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]benzenesulfonamide Traditional Name: 3,4-dimethoxy-N-[4-[4-(m-tolyl)piperazino]butyl]benzenesulfonamide Formula: C23H33N3O4S MolecularWeight: 447.59082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33N3O4S/c1-19-7-6-8-20(17-19)26-15-13-25(14-16-26)12-5-4-11-24-31(27,28)21-9-10-22(29-2)23(18-21)30-3/h6-10,17-18,24H,4-5,11-16H2,1-3H3