N-butyl-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-butyl-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-butyl-3-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-butyl-3-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: N-butyl-3-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-butyl-3-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]benzenesulfonamide Formula: C22H26F3N3O3S MolecularWeight: 469.52035

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26F3N3O3S/c1-2-3-10-26-32(30,31)20-9-4-6-17(15-20)21(29)28-13-11-27(12-14-28)19-8-5-7-18(16-19)22(23,24)25/h4-9,15-16,26H,2-3,10-14H2,1H3