N-[[4-(azepan-1-ylcarbonyl)phenyl]methyl]-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[[4-(azepan-1-ylcarbonyl)phenyl]methyl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[[4-(azepane-1-carbonyl)phenyl]methyl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[[4-[1-azepanyl(oxo)methyl]phenyl]methyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[[4-(azepane-1-carbonyl)phenyl]methyl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[4-(azepane-1-carbonyl)benzyl]-2,5-dimethyl-benzenesulfonamide Formula: C22H28N2O3S MolecularWeight: 400.53432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCCCCC3

InChI

InChI=1S/C22H28N2O3S/c1-17-7-8-18(2)21(15-17)28(26,27)23-16-19-9-11-20(12-10-19)22(25)24-13-5-3-4-6-14-24/h7-12,15,23H,3-6,13-14,16H2,1-2H3