5-(azepan-1-ylcarbonyl)-2-methyl-N-(4-methylphenyl)benzenesulfonamide

Systemtic Name: 5-(azepan-1-ylcarbonyl)-2-methyl-N-(4-methylphenyl)benzenesulfonamide Openeye Name: 5-(azepane-1-carbonyl)-2-methyl-N-(p-tolyl)benzenesulfonamide CAS Name: 5-[1-azepanyl(oxo)methyl]-2-methyl-N-(4-methylphenyl)benzenesulfonamide IUPAC Name: 5-(azepane-1-carbonyl)-2-methyl-N-(4-methylphenyl)benzenesulfonamide Traditional Name: 5-(azepane-1-carbonyl)-2-methyl-N-(p-tolyl)benzenesulfonamide Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCCCCC3)C

InChI

InChI=1S/C21H26N2O3S/c1-16-7-11-19(12-8-16)22-27(25,26)20-15-18(10-9-17(20)2)21(24)23-13-5-3-4-6-14-23/h7-12,15,22H,3-6,13-14H2,1-2H3