4-chloranyl-N-[1-(4-fluorophenyl)ethyl]-N-[(3R)-2-oxidanylideneazepan-3-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-(4-fluorophenyl)ethyl]-N-[(3R)-2-oxidanylideneazepan-3-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[1-(4-fluorophenyl)ethyl]-N-[(3R)-2-oxoazepan-3-yl]benzenesulfonamide CAS Name: 4-chloro-N-[1-(4-fluorophenyl)ethyl]-N-[(3R)-2-oxo-3-azepanyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[1-(4-fluorophenyl)ethyl]-N-[(3R)-2-oxoazepan-3-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[1-(4-fluorophenyl)ethyl]-N-[(3R)-2-ketoazepan-3-yl]benzenesulfonamide Formula: C20H22ClFN2O3S MolecularWeight: 424.916683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)N(C2CCCCNC2=O)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)F)N([C@@H]2CCCCNC2=O)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClFN2O3S/c1-14(15-5-9-17(22)10-6-15)24(19-4-2-3-13-23-20(19)25)28(26,27)18-11-7-16(21)8-12-18/h5-12,14,19H,2-4,13H2,1H3,(H,23,25)/t14?,19-/m1/s1