N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-[(2-chloro-6-fluoro-phenyl)methyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-N-[(2-chloro-6-fluorophenyl)methyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-N-[(2-chloro-6-fluorophenyl)methyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-N-(2-chloro-6-fluoro-benzyl)-4-methyl-benzenesulfonamide Formula: C22H26ClFN2O3S MolecularWeight: 452.969843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=C(C=CC=C2Cl)F)CC(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=C(C=CC=C2Cl)F)CC(=O)N3CCCCCC3

InChI

InChI=1S/C22H26ClFN2O3S/c1-17-9-11-18(12-10-17)30(28,29)26(15-19-20(23)7-6-8-21(19)24)16-22(27)25-13-4-2-3-5-14-25/h6-12H,2-5,13-16H2,1H3