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CHEBI:82867 - (R)-diflumetorim

ChEBI IDCHEBI:82867
ChEBI Name(R)-diflumetorim
Stars
ASCII Name(R)-diflumetorim
DefinitionA 5-chloro-N-{1-[4-(difluoromethoxy)phenyl]propyl}-6-methylpyrimidin-4-amine that is the (R)-enantiomer of diflumetorim.
Last Modified5 September 2014
SubmitterSteve
DownloadsMolfile
FormulaC15H16ClF2N3O
Net Charge0
Average Mass327.762
Monoisotopic Mass327.09500
SMILESCC[C@@H](Nc1ncnc(C)c1Cl)c1ccc(OC(F)F)cc1
InChIInChI=1S/C15H16ClF2N3O/c1-3-12(21-14-13(16)9(2)19-8-20-14)10-4-6-11(7-5-10)22-15(17)18/h4-8,12,15H,3H2,1-2H3,(H,19,20,21)/t12-/m1/s1
InChIKeyNEKULYKCZPJMMJ-GFCCVEGCSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
(R)-diflumetorim (CHEBI:82867) is a 5-chloro-N-{1-[4-(difluoromethoxy)phenyl]propyl}-6-methylpyrimidin-4-amine (CHEBI:82861)
(R)-diflumetorim (CHEBI:82867) is enantiomer of (S)-diflumetorim (CHEBI:82868)
Incoming Relation(s)
diflumetorim (CHEBI:82860) has part (R)-diflumetorim (CHEBI:82867)
(S)-diflumetorim (CHEBI:82868) is enantiomer of (R)-diflumetorim (CHEBI:82867)
IUPAC Name 
5-chloro-N-{(1R)-1-[4-(difluoromethoxy)phenyl]propyl}-6-methylpyrimidin-4-amine