N-[2-(azepan-1-ylcarbonyl)phenyl]-2-[(3-ethanoylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-[(3-ethanoylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: 2-(3-acetyl-N-methylsulfonyl-anilino)-N-[2-(azepane-1-carbonyl)phenyl]acetamide CAS Name: 2-(3-acetyl-N-methylsulfonylanilino)-N-[2-[1-azepanyl(oxo)methyl]phenyl]acetamide IUPAC Name: 2-(3-acetyl-N-methylsulfonylanilino)-N-[2-(azepane-1-carbonyl)phenyl]acetamide Traditional Name: 2-(3-acetyl-N-mesyl-anilino)-N-[2-(azepane-1-carbonyl)phenyl]acetamide Formula: C24H29N3O5S MolecularWeight: 471.56916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N(CC(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N(CC(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)S(=O)(=O)C

InChI

InChI=1S/C24H29N3O5S/c1-18(28)19-10-9-11-20(16-19)27(33(2,31)32)17-23(29)25-22-13-6-5-12-21(22)24(30)26-14-7-3-4-8-15-26/h5-6,9-13,16H,3-4,7-8,14-15,17H2,1-2H3,(H,25,29)