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CHEBI:77045 - (S)-bromisoval

ChEBI IDCHEBI:77045
ChEBI Name(S)-bromisoval
Stars
ASCII Name(S)-bromisoval
DefinitionA 2-bromo-N-carbamoyl-3-methylbutanamide that has S configuration.
Last Modified21 January 2014
SubmitterGareth Owen
DownloadsMolfile
FormulaC6H11BrN2O2
Net Charge0
Average Mass223.070
Monoisotopic Mass222.00039
SMILESCC(C)[C@H](Br)C(=O)NC(N)=O
InChIInChI=1S/C6H11BrN2O2/c1-3(2)4(7)5(10)9-6(8)11/h3-4H,1-2H3,(H3,8,9,10,11)/t4-/m0/s1
InChIKeyCMCCHHWTTBEZNM-BYPYZUCNSA-N
ChEBI Ontology
Outgoing Relation(s)
(S)-bromisoval (CHEBI:77045) is a 2-bromo-N-carbamoyl-3-methylbutanamide (CHEBI:77043)
(S)-bromisoval (CHEBI:77045) is enantiomer of (R)-bromisoval (CHEBI:77044)
Incoming Relation(s)
bromisoval (CHEBI:31304) has part (S)-bromisoval (CHEBI:77045)
(R)-bromisoval (CHEBI:77044) is enantiomer of (S)-bromisoval (CHEBI:77045)
IUPAC Name 
(2S)-2-bromo-N-carbamoyl-3-methylbutanamide
Synonyms  Source
(−)-bromisovalChEBI
(S)-(−)-bromisovalChEBI
[(S)-α-bromo-isovaleryl]ureaChEBI
(S)-2-bromoisovalerylureaChEBI
Registry NumbersSources
Reaxys:1724351Reaxys
Citations