N-methyl-N-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonylphenyl]ethanesulfonamide

Systemtic Name: N-methyl-N-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonylphenyl]ethanesulfonamide Openeye Name: N-methyl-N-[4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]phenyl]ethanesulfonamide CAS Name: N-methyl-N-[4-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]phenyl]ethanesulfonamide IUPAC Name: N-methyl-N-[4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]phenyl]ethanesulfonamide Traditional Name: N-methyl-N-[4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]phenyl]ethanesulfonamide Formula: C21H24F3N3O3S MolecularWeight: 455.49377

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCS(=O)(=O)N(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H24F3N3O3S/c1-3-31(29,30)25(2)18-9-7-16(8-10-18)20(28)27-13-11-26(12-14-27)19-6-4-5-17(15-19)21(22,23)24/h4-10,15H,3,11-14H2,1-2H3