4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide Openeye Name: 4-chloro-N-[(4-isopropoxyphenyl)methyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: 4-chloro-N-(2-oxo-3-azepanyl)-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(2-oxoazepan-3-yl)-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide Traditional Name: 4-chloro-N-(4-isopropoxybenzyl)-N-(2-ketoazepan-3-yl)benzenesulfonamide Formula: C22H27ClN2O4S MolecularWeight: 450.97878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CN(C2CCCCNC2=O)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CN(C2CCCCNC2=O)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H27ClN2O4S/c1-16(2)29-19-10-6-17(7-11-19)15-25(21-5-3-4-14-24-22(21)26)30(27,28)20-12-8-18(23)9-13-20/h6-13,16,21H,3-5,14-15H2,1-2H3,(H,24,26)