N-[[4-(azepan-1-ylcarbonyl)phenyl]methyl]-4-bromanyl-benzenesulfonamide

Systemtic Name: N-[[4-(azepan-1-ylcarbonyl)phenyl]methyl]-4-bromanyl-benzenesulfonamide Openeye Name: N-[[4-(azepane-1-carbonyl)phenyl]methyl]-4-bromo-benzenesulfonamide CAS Name: N-[[4-[1-azepanyl(oxo)methyl]phenyl]methyl]-4-bromobenzenesulfonamide IUPAC Name: N-[[4-(azepane-1-carbonyl)phenyl]methyl]-4-bromobenzenesulfonamide Traditional Name: N-[4-(azepane-1-carbonyl)benzyl]-4-bromo-benzenesulfonamide Formula: C20H23BrN2O3S MolecularWeight: 451.37722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H23BrN2O3S/c21-18-9-11-19(12-10-18)27(25,26)22-15-16-5-7-17(8-6-16)20(24)23-13-3-1-2-4-14-23/h5-12,22H,1-4,13-15H2