CHEBI:133306 - [methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-λ6-sulfanylidene]cyanamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name [methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-λ6-sulfanylidene]cyanamide
ChEBI ID CHEBI:133306
ChEBI ASCII Name [methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-lambda(6)-sulfanylidene]cyanamide
Definition A member of the class of pyridines that is 5-ethyl-2-trifluoromethylpyridine in which the ethyl group is substituted at position 1 by an N-cyano-S-methylsulfonimidoyl group. The insecticide sulfoxalor is a mixture of the four possible stereoisomers arising from the two tetrahedral stereocentres.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C10H10F3N3OS
Net Charge 0
Average Mass 277.268
Monoisotopic Mass 277.04967
InChI InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3
InChIKey ZVQOOHYFBIDMTQ-UHFFFAOYSA-N
SMILES C=1(C=NC(=CC1)C(F)(F)F)C(S(C)(=NC#N)=O)C
ChEBI Ontology
Outgoing [methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-λ6-sulfanylidene]cyanamide (CHEBI:133306) is a nitrile (CHEBI:18379)
[methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-λ6-sulfanylidene]cyanamide (CHEBI:133306) is a organofluorine compound (CHEBI:37143)
[methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-λ6-sulfanylidene]cyanamide (CHEBI:133306) is a pyridines (CHEBI:26421)
[methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-λ6-sulfanylidene]cyanamide (CHEBI:133306) is a sulfoximide (CHEBI:38084)
Incoming (RC,RS)-sulfoxaflor (CHEBI:133311) is a [methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-λ6-sulfanylidene]cyanamide (CHEBI:133306)
(RC,SS)-sulfoxaflor (CHEBI:133312) is a [methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-λ6-sulfanylidene]cyanamide (CHEBI:133306)
(SC,RS)-sulfoxaflor (CHEBI:133315) is a [methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-λ6-sulfanylidene]cyanamide (CHEBI:133306)
(SC,SS)-sulfoxaflor (CHEBI:133313) is a [methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-λ6-sulfanylidene]cyanamide (CHEBI:133306)
IUPAC Name
[methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-λ6-sulfanylidene]cyanamide
Manual Xref Database
1669 PPDB
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Last Modified
16 September 2016
General Comment
2016-09-16 This is the entry for material with unspecified stereochemistry. There are separate entries for the individual stereoisomers, as well as for the mixture of the four stereoisomers arising from the two tetrahedral chiral centres (sulfoxalor).