N-[2-(azepan-1-ylcarbonyl)phenyl]-2-methyl-3-(methylsulfonylamino)benzamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-methyl-3-(methylsulfonylamino)benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-3-(methanesulfonamido)-2-methyl-benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-3-(methanesulfonamido)-2-methylbenzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-3-(methanesulfonamido)-2-methylbenzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-3-(methanesulfonamido)-2-methyl-benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NS(=O)(=O)C)C(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=CC=C1NS(=O)(=O)C)C(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3

InChI

InChI=1S/C22H27N3O4S/c1-16-17(11-9-13-19(16)24-30(2,28)29)21(26)23-20-12-6-5-10-18(20)22(27)25-14-7-3-4-8-15-25/h5-6,9-13,24H,3-4,7-8,14-15H2,1-2H3,(H,23,26)