3-(azepan-1-ylcarbonyl)-N-(4-methoxyphenyl)-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-(4-methoxyphenyl)-N-(phenylmethyl)benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-benzyl-N-(4-methoxyphenyl)benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-(4-methoxyphenyl)-N-(phenylmethyl)benzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-benzyl-N-(4-methoxyphenyl)benzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-benzyl-N-(4-methoxyphenyl)benzenesulfonamide Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)N4CCCCCC4

InChI

InChI=1S/C27H30N2O4S/c1-33-25-16-14-24(15-17-25)29(21-22-10-5-4-6-11-22)34(31,32)26-13-9-12-23(20-26)27(30)28-18-7-2-3-8-19-28/h4-6,9-17,20H,2-3,7-8,18-19,21H2,1H3