3-(azepan-1-ylsulfonyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[[3-(isopropylsulfamoyl)phenyl]methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[3-(isopropylsulfamoyl)benzyl]benzamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O5S2/c1-18(2)25-32(28,29)21-11-7-9-19(15-21)17-24-23(27)20-10-8-12-22(16-20)33(30,31)26-13-5-3-4-6-14-26/h7-12,15-16,18,25H,3-6,13-14,17H2,1-2H3,(H,24,27)