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CHEBI:93874 - 2-[2-(methylsulfamoyl)-5-(trifluoromethyl)phenyl]sulfinylbenzoic acid

Default Structure
ChEBI IDCHEBI:93874
ChEBI Name2-[2-(methylsulfamoyl)-5-(trifluoromethyl)phenyl]sulfinylbenzoic acid
Stars
DownloadsMolfile
FormulaC15H12F3NO5S2
Net Charge0
Average Mass407.391
Monoisotopic Mass407.01090
SMILESCNS(=O)(=O)c1ccc(C(F)(F)F)cc1S(=O)c1ccccc1C(=O)O
InChIInChI=1S/C15H12F3NO5S2/c1-19-26(23,24)13-7-6-9(15(16,17)18)8-12(13)25(22)11-5-3-2-4-10(11)14(20)21/h2-8,19H,1H3,(H,20,21)
InChIKeyPINDQHQXJFMBBT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[2-(methylsulfamoyl)-5-(trifluoromethyl)phenyl]sulfinylbenzoic acid (CHEBI:93874) is a carbonyl compound (CHEBI:36586)
Manual XrefsDatabases
LSM-4448LINCS