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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[[3-(methylsulfonylamino)phenyl]methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[3-(methanesulfonamido)benzyl]benzamide Formula: C21H27N3O5S2 MolecularWeight: 465.58618

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H27N3O5S2/c1-30(26,27)23-19-10-6-8-17(14-19)16-22-21(25)18-9-7-11-20(15-18)31(28,29)24-12-4-2-3-5-13-24/h6-11,14-15,23H,2-5,12-13,16H2,1H3,(H,22,25)