N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(phenylmethyl)-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(phenylmethyl)-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-benzyl-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-N-(phenylmethyl)-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-N-benzyl-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-N-benzyl-3-(trifluoromethyl)benzenesulfonamide Formula: C22H25F3N2O3S MolecularWeight: 454.50571

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)C(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H25F3N2O3S/c23-22(24,25)19-11-8-12-20(15-19)31(29,30)27(16-18-9-4-3-5-10-18)17-21(28)26-13-6-1-2-7-14-26/h3-5,8-12,15H,1-2,6-7,13-14,16-17H2