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

Systemtic Name: 4-chloranyl-N-[[4-(2-methylphenyl)phenyl]methyl]-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide Openeye Name: 4-chloro-N-[[4-(o-tolyl)phenyl]methyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: 4-chloro-N-[[4-(2-methylphenyl)phenyl]methyl]-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: 4-chloro-N-[[4-(2-methylphenyl)phenyl]methyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: 4-chloro-N-(2-ketoazepan-3-yl)-N-[4-(o-tolyl)benzyl]benzenesulfonamide Formula: C26H27ClN2O3S MolecularWeight: 483.02218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC=C(C=C2)CN(C3CCCCNC3=O)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=CC=C1C2=CC=C(C=C2)CN(C3CCCCNC3=O)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H27ClN2O3S/c1-19-6-2-3-7-24(19)21-11-9-20(10-12-21)18-29(25-8-4-5-17-28-26(25)30)33(31,32)23-15-13-22(27)14-16-23/h2-3,6-7,9-16,25H,4-5,8,17-18H2,1H3,(H,28,30)