EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:138418 - flucarbazone(1−)

ChEBI IDCHEBI:138418
ChEBI Nameflucarbazone(1−)
Stars
ASCII Nameflucarbazone(1-)
DefinitionAn organic nitrogen anion resulting from the deprotonation of the sulfonamide nitrogen of flucarbazone.
Last Modified11 September 2017
SubmitterGareth Owen
DownloadsMolfile
FormulaC12H10F3N4O6S
Net Charge-1
Average Mass395.295
Monoisotopic Mass395.02786
SMILESCOc1nn(C(=O)[N-]S(=O)(=O)c2ccccc2OC(F)(F)F)c(=O)n1C
InChIInChI=1S/C12H11F3N4O6S/c1-18-10(24-2)16-19(11(18)21)9(20)17-26(22,23)8-6-4-3-5-7(8)25-12(13,14)15/h3-6H,1-2H3,(H,17,20)/p-1
InChIKeyGINFBXXYGUODAT-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
flucarbazone(1−) (CHEBI:138418) is a organic nitrogen anion (CHEBI:50335)
flucarbazone(1−) (CHEBI:138418) is conjugate base of flucarbazone (CHEBI:138417)
Incoming Relation(s)
flucarbazone-sodium (CHEBI:82010) has part flucarbazone(1−) (CHEBI:138418)
flucarbazone (CHEBI:138417) is conjugate acid of flucarbazone(1−) (CHEBI:138418)
IUPAC Name 
[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]{[2-(trifluoromethoxy)phenyl]sulfonyl}azanide
Synonym  Source
flucarbazone anionChEBI