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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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