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

Systemtic Name: N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[4-[4-(m-tolyl)piperazin-1-yl]butyl]-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[4-[4-(3-methylphenyl)-1-piperazinyl]butyl]-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[4-[4-(m-tolyl)piperazino]butyl]-4-(trifluoromethoxy)benzenesulfonamide Formula: C22H28F3N3O3S MolecularWeight: 471.53623

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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(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C22H28F3N3O3S/c1-18-5-4-6-19(17-18)28-15-13-27(14-16-28)12-3-2-11-26-32(29,30)21-9-7-20(8-10-21)31-22(23,24)25/h4-10,17,26H,2-3,11-16H2,1H3