4-chloranyl-N-[[3-(4-fluoranylphenoxy)phenyl]methyl]-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[[3-(4-fluoranylphenoxy)phenyl]methyl]-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide Openeye Name: 4-chloro-N-[[3-(4-fluorophenoxy)phenyl]methyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: 4-chloro-N-[[3-(4-fluorophenoxy)phenyl]methyl]-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: 4-chloro-N-[[3-(4-fluorophenoxy)phenyl]methyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: 4-chloro-N-[3-(4-fluorophenoxy)benzyl]-N-(2-ketoazepan-3-yl)benzenesulfonamide Formula: C25H24ClFN2O4S MolecularWeight: 502.985463

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CC(=CC=C2)OC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(CC2=CC(=CC=C2)OC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H24ClFN2O4S/c26-19-7-13-23(14-8-19)34(31,32)29(24-6-1-2-15-28-25(24)30)17-18-4-3-5-22(16-18)33-21-11-9-20(27)10-12-21/h3-5,7-14,16,24H,1-2,6,15,17H2,(H,28,30)