4-bromanyl-3-(2-methylsulfanylethylsulfamoyl)benzoic acid

Systemtic Name: 4-bromanyl-3-(2-methylsulfanylethylsulfamoyl)benzoic acid Openeye Name: 4-bromo-3-(2-methylsulfanylethylsulfamoyl)benzoic acid CAS Name: 4-bromo-3-[2-(methylthio)ethylsulfamoyl]benzoic acid IUPAC Name: 4-bromo-3-(2-methylsulfanylethylsulfamoyl)benzoic acid Traditional Name: 4-bromo-3-[2-(methylthio)ethylsulfamoyl]benzoic acid Formula: C10H12BrNO4S2 MolecularWeight: 354.24058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)Br

Isomeric SMILES

CSCCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)Br

InChI

InChI=1S/C10H12BrNO4S2/c1-17-5-4-12-18(15,16)9-6-7(10(13)14)2-3-8(9)11/h2-3,6,12H,4-5H2,1H3,(H,13,14)