N-[4-(azepan-1-ylcarbonyl)phenyl]-3,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[4-(azepan-1-ylcarbonyl)phenyl]-3,4-dimethyl-benzenesulfonamide Openeye Name: N-[4-(azepane-1-carbonyl)phenyl]-3,4-dimethyl-benzenesulfonamide CAS Name: N-[4-[1-azepanyl(oxo)methyl]phenyl]-3,4-dimethylbenzenesulfonamide IUPAC Name: N-[4-(azepane-1-carbonyl)phenyl]-3,4-dimethylbenzenesulfonamide Traditional Name: N-[4-(azepane-1-carbonyl)phenyl]-3,4-dimethyl-benzenesulfonamide Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCCCCC3)C

InChI

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