N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-[4-chloranyl-3-(trifluoromethyl)phenyl]methanesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-[4-chloranyl-3-(trifluoromethyl)phenyl]methanesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]methanesulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]methanesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]methanesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]methanesulfonamide Formula: C16H20ClF3N2O3S MolecularWeight: 412.85481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)N1CCCCCC1)C2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)N(CC(=O)N1CCCCCC1)C2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C16H20ClF3N2O3S/c1-26(24,25)22(11-15(23)21-8-4-2-3-5-9-21)12-6-7-14(17)13(10-12)16(18,19)20/h6-7,10H,2-5,8-9,11H2,1H3