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

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-[(2-fluorophenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(2-fluoro-N-methylsulfonyl-anilino)acetamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-2-(2-fluoro-N-methylsulfonylanilino)acetamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(2-fluoro-N-methylsulfonylanilino)acetamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(2-fluoro-N-mesyl-anilino)acetamide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)N2CCCCCC2)C3=CC=CC=C3F

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)N2CCCCCC2)C3=CC=CC=C3F

InChI

InChI=1S/C22H26FN3O4S/c1-31(29,30)26(20-13-7-5-11-18(20)23)16-21(27)24-19-12-6-4-10-17(19)22(28)25-14-8-2-3-9-15-25/h4-7,10-13H,2-3,8-9,14-16H2,1H3,(H,24,27)