N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-4-ethanoyl-N-[(4-fluorophenyl)methyl]benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-4-ethanoyl-N-[(4-fluorophenyl)methyl]benzenesulfonamide Openeye Name: 4-acetyl-N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-[(4-fluorophenyl)methyl]benzenesulfonamide CAS Name: 4-acetyl-N-[2-(1-azepanyl)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]benzenesulfonamide IUPAC Name: 4-acetyl-N-[2-(azepan-1-yl)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]benzenesulfonamide Traditional Name: 4-acetyl-N-[2-(azepan-1-yl)-2-keto-ethyl]-N-(4-fluorobenzyl)benzenesulfonamide Formula: C23H27FN2O4S MolecularWeight: 446.534883

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)F)CC(=O)N3CCCCCC3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)F)CC(=O)N3CCCCCC3

InChI

InChI=1S/C23H27FN2O4S/c1-18(27)20-8-12-22(13-9-20)31(29,30)26(16-19-6-10-21(24)11-7-19)17-23(28)25-14-4-2-3-5-15-25/h6-13H,2-5,14-17H2,1H3