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CHEBI:64126 - 5-(methylsulfanyl)-2-(thiophen-2-yl)-3-(trifluoromethyl)pyridine-4-carbonitrile

ChEBI IDCHEBI:64126
ChEBI Name5-(methylsulfanyl)-2-(thiophen-2-yl)-3-(trifluoromethyl)pyridine-4-carbonitrile
Stars
DefinitionA nitrile that pyridine which is substituted by 2-thienyl, trifluoromethyl, cyano and methylthio groups at positions 2, 3, 4 and 5 respectively.
Last Modified6 July 2016
SubmitterAnne Morgat
DownloadsMolfile
FormulaC12H7F3N2S2
Net Charge0
Average Mass300.330
Monoisotopic Mass300.00027
SMILESCSc1cnc(-c2cccs2)c(C(F)(F)F)c1C#N
InChIInChI=1S/C12H7F3N2S2/c1-18-9-6-17-11(8-3-2-4-19-8)10(7(9)5-16)12(13,14)15/h2-4,6H,1H3
InChIKeyGQRYFYZPKOWESQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-(methylsulfanyl)-2-(thiophen-2-yl)-3-(trifluoromethyl)pyridine-4-carbonitrile (CHEBI:64126) is a aryl sulfide (CHEBI:35683)
5-(methylsulfanyl)-2-(thiophen-2-yl)-3-(trifluoromethyl)pyridine-4-carbonitrile (CHEBI:64126) is a nitrile (CHEBI:18379)
5-(methylsulfanyl)-2-(thiophen-2-yl)-3-(trifluoromethyl)pyridine-4-carbonitrile (CHEBI:64126) is a organofluorine compound (CHEBI:37143)
5-(methylsulfanyl)-2-(thiophen-2-yl)-3-(trifluoromethyl)pyridine-4-carbonitrile (CHEBI:64126) is a pyridines (CHEBI:26421)
5-(methylsulfanyl)-2-(thiophen-2-yl)-3-(trifluoromethyl)pyridine-4-carbonitrile (CHEBI:64126) is a thiophenes (CHEBI:26961)
IUPAC Name 
5-(methylsulfanyl)-2-(2-thienyl)-3-(trifluoromethyl)isonicotinonitrile
Synonyms  Source
4-cyano-5-(methylsulfanyl)-2-(2-thienyl)-3-(trifluoromethyl)pyridineChEBI
4-cyano-5-(methylthio)-2-(2-thienyl)-3-(trifluoromethyl)pyridineChEBI
5-(methylthio)-2-(2-thienyl)-3-(trifluoromethyl)isonicotinonitrileChEBI
5-(methylthio)-2-(thiophen-2-yl)-3-(trifluoromethyl)pyridine-4-carbonitrileChEBI