3-[[[3-(azepan-1-ylsulfonyl)phenyl]carbonylamino]methyl]-N-methyl-benzamide

Systemtic Name: 3-[[[3-(azepan-1-ylsulfonyl)phenyl]carbonylamino]methyl]-N-methyl-benzamide Openeye Name: 3-[[[3-(azepan-1-ylsulfonyl)benzoyl]amino]methyl]-N-methyl-benzamide CAS Name: 3-[[[[3-(1-azepanylsulfonyl)phenyl]-oxomethyl]amino]methyl]-N-methylbenzamide IUPAC Name: 3-[[[3-(azepan-1-ylsulfonyl)benzoyl]amino]methyl]-N-methylbenzamide Traditional Name: 3-[[[3-(azepan-1-ylsulfonyl)benzoyl]amino]methyl]-N-methyl-benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H27N3O4S/c1-23-21(26)18-9-6-8-17(14-18)16-24-22(27)19-10-7-11-20(15-19)30(28,29)25-12-4-2-3-5-13-25/h6-11,14-15H,2-5,12-13,16H2,1H3,(H,23,26)(H,24,27)