3-(azepan-1-ylcarbonyl)-4-methoxy-N-[1-(4-methylphenyl)propyl]benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-4-methoxy-N-[1-(4-methylphenyl)propyl]benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[1-(p-tolyl)propyl]benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-4-methoxy-N-[1-(4-methylphenyl)propyl]benzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[1-(4-methylphenyl)propyl]benzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[1-(p-tolyl)propyl]benzenesulfonamide Formula: C24H32N2O4S MolecularWeight: 444.58688

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

Isomeric SMILES

CCC(C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

InChI

InChI=1S/C24H32N2O4S/c1-4-22(19-11-9-18(2)10-12-19)25-31(28,29)20-13-14-23(30-3)21(17-20)24(27)26-15-7-5-6-8-16-26/h9-14,17,22,25H,4-8,15-16H2,1-3H3