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Analyte Name
3-chloro-4-(2-((2-methyl-2-(4-(trifluoromethyl)phenyl)sulfonylpropanoyl)amino)ethylsulfanyl)benzoic acid
Molecular Formula
C20 H19 Cl F3 N O5 S2
Molecular Weight
509.947
Accurate Mass
509.035
SMILES
CC(C)(C(=O)NCCSc1ccc(cc1Cl)C(=O)O)S(=O)(=O)c2ccc(cc2)C(F)(F)F
InChI
InChI=1S/C20H19ClF3NO5S2/c1-19(2,32(29,30)14-6-4-13(5-7-14)20(22,23)24)18(28)25-9-10-31-16-8-3-12(17(26)27)11-15(16)21/h3-8,11H,9-10H2,1-2H3,(H,25,28)(H,26,27)
IUPAC
3-chloro-4-[2-[[2-methyl-2-[4-(trifluoromethyl)phenyl]sulfonylpropanoyl]amino]ethylsulfanyl]benzoic acid
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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