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

Systemtic Name: N-cyclopropyl-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-cyclopropyl-4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-cyclopropyl-4-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-cyclopropyl-4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]benzenesulfonamide Formula: C21H22F3N3O3S MolecularWeight: 453.47789

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H22F3N3O3S/c22-21(23,24)16-2-1-3-18(14-16)26-10-12-27(13-11-26)20(28)15-4-8-19(9-5-15)31(29,30)25-17-6-7-17/h1-5,8-9,14,17,25H,6-7,10-13H2