3-(azepan-1-ylcarbonyl)-4-methoxy-N-[2-[methyl(phenyl)amino]ethyl]benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-4-methoxy-N-[2-[methyl(phenyl)amino]ethyl]benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[2-(N-methylanilino)ethyl]benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-4-methoxy-N-[2-(N-methylanilino)ethyl]benzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[2-(N-methylanilino)ethyl]benzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[2-(N-methylanilino)ethyl]benzenesulfonamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCNS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)N2CCCCCC2)C3=CC=CC=C3

Isomeric SMILES

CN(CCNS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)N2CCCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C23H31N3O4S/c1-25(19-10-6-5-7-11-19)17-14-24-31(28,29)20-12-13-22(30-2)21(18-20)23(27)26-15-8-3-4-9-16-26/h5-7,10-13,18,24H,3-4,8-9,14-17H2,1-2H3