2-[2-(tert-butylsulfamoyl)-5-chloranyl-phenyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-(tert-butylsulfamoyl)-5-chloranyl-phenyl]sulfanylbenzoic acid Openeye Name: 2-[2-(tert-butylsulfamoyl)-5-chloro-phenyl]sulfanylbenzoic acid CAS Name: 2-[[2-(tert-butylsulfamoyl)-5-chlorophenyl]thio]benzoic acid IUPAC Name: 2-[2-(tert-butylsulfamoyl)-5-chlorophenyl]sulfanylbenzoic acid Traditional Name: 2-[[2-(tert-butylsulfamoyl)-5-chloro-phenyl]thio]benzoic acid Formula: C17H18ClNO4S2 MolecularWeight: 399.91212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=C(C=C(C=C1)Cl)SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=C(C=C(C=C1)Cl)SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C17H18ClNO4S2/c1-17(2,3)19-25(22,23)15-9-8-11(18)10-14(15)24-13-7-5-4-6-12(13)16(20)21/h4-10,19H,1-3H3,(H,20,21)