3-(2,2-dimethylpropylamino)-5-(methylsulfamoyl)-N-(3-methylsulfanylphenyl)benzamide

Systemtic Name: 3-(2,2-dimethylpropylamino)-5-(methylsulfamoyl)-N-(3-methylsulfanylphenyl)benzamide Openeye Name: 3-(2,2-dimethylpropylamino)-5-(methylsulfamoyl)-N-(3-methylsulfanylphenyl)benzamide CAS Name: 3-(2,2-dimethylpropylamino)-5-(methylsulfamoyl)-N-[3-(methylthio)phenyl]benzamide IUPAC Name: 3-(2,2-dimethylpropylamino)-5-(methylsulfamoyl)-N-(3-methylsulfanylphenyl)benzamide Traditional Name: 3-(methylsulfamoyl)-N-[3-(methylthio)phenyl]-5-(neopentylamino)benzamide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC1=CC(=CC(=C1)C(=O)NC2=CC(=CC=C2)SC)S(=O)(=O)NC

Isomeric SMILES

CC(C)(C)CNC1=CC(=CC(=C1)C(=O)NC2=CC(=CC=C2)SC)S(=O)(=O)NC

InChI

InChI=1S/C20H27N3O3S2/c1-20(2,3)13-22-16-9-14(10-18(12-16)28(25,26)21-4)19(24)23-15-7-6-8-17(11-15)27-5/h6-12,21-22H,13H2,1-5H3,(H,23,24)