N-[2-(azepan-1-ylcarbonyl)phenyl]-2-chloranyl-4-(methylsulfonylamino)benzamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-chloranyl-4-(methylsulfonylamino)benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-2-chloro-4-(methanesulfonamido)benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-2-chloro-4-(methanesulfonamido)benzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-2-chloro-4-(methanesulfonamido)benzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-2-chloro-4-(methanesulfonamido)benzamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC(=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)Cl

Isomeric SMILES

CS(=O)(=O)NC1=CC(=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C21H24ClN3O4S/c1-30(28,29)24-15-10-11-16(18(22)14-15)20(26)23-19-9-5-4-8-17(19)21(27)25-12-6-2-3-7-13-25/h4-5,8-11,14,24H,2-3,6-7,12-13H2,1H3,(H,23,26)