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

Systemtic Name: 4-ethyl-3-(2-methylsulfanylethylsulfamoyl)benzoic acid Openeye Name: 4-ethyl-3-(2-methylsulfanylethylsulfamoyl)benzoic acid CAS Name: 4-ethyl-3-[2-(methylthio)ethylsulfamoyl]benzoic acid IUPAC Name: 4-ethyl-3-(2-methylsulfanylethylsulfamoyl)benzoic acid Traditional Name: 4-ethyl-3-[2-(methylthio)ethylsulfamoyl]benzoic acid Formula: C12H17NO4S2 MolecularWeight: 303.39768

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NCCSC

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NCCSC

InChI

InChI=1S/C12H17NO4S2/c1-3-9-4-5-10(12(14)15)8-11(9)19(16,17)13-6-7-18-2/h4-5,8,13H,3,6-7H2,1-2H3,(H,14,15)