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

Systemtic Name: 3-(azepan-1-ylcarbonyl)-4-methoxy-N-[(4-methylphenyl)-phenyl-methyl]benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[phenyl(p-tolyl)methyl]benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-4-methoxy-N-[(4-methylphenyl)-phenylmethyl]benzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[(4-methylphenyl)-phenylmethyl]benzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[phenyl(p-tolyl)methyl]benzenesulfonamide Formula: C28H32N2O4S MolecularWeight: 492.62968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)OC)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)OC)C(=O)N4CCCCCC4

InChI

InChI=1S/C28H32N2O4S/c1-21-12-14-23(15-13-21)27(22-10-6-5-7-11-22)29-35(32,33)24-16-17-26(34-2)25(20-24)28(31)30-18-8-3-4-9-19-30/h5-7,10-17,20,27,29H,3-4,8-9,18-19H2,1-2H3