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2-[[4-(4-chlorophenyl)-5-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]thio]acetonitrile
SpectraBase Compound ID 9plcdStxIq1
InChI InChI=1S/C16H8Cl2F3N5S/c17-10-1-3-11(4-2-10)26-14(24-25-15(26)27-6-5-22)13-12(18)7-9(8-23-13)16(19,20)21/h1-4,7-8H,6H2
InChIKey GDFCGPZPQAYLTK-UHFFFAOYSA-N
Mol Weight 430.24 g/mol
Molecular Formula C16H8Cl2F3N5S
Exact Mass 428.982956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3hVPDrI3Op
Name 2-[[4-(4-chlorophenyl)-5-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]thio]acetonitrile
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Formula C16H8Cl2F3N5S
InChI InChI=1S/C16H8Cl2F3N5S/c17-10-1-3-11(4-2-10)26-14(24-25-15(26)27-6-5-22)13-12(18)7-9(8-23-13)16(19,20)21/h1-4,7-8H,6H2
InChIKey GDFCGPZPQAYLTK-UHFFFAOYSA-N
Molecular Weight 430.236 g/mol
SMILES c1([n](c(SCC#N)nn1)-c1ccc(cc1)Cl)-c1ncc(C(F)(F)F)cc1Cl
SPLASH splash10-0udi-4901100000-6afe9520a2aa29723f7e
Synonyms 2-[[4-(4-chlorophenyl)-5-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-1,2,4-triazol-3-yl]sulfanyl]acetonitrile 2-[[4-(4-chlorophenyl)-5-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-1,2,4-triazol-3-yl]thio]acetonitrile 2-[[4-(4-chlorophenyl)-5-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,2,4-triazol-3-yl]sulfanyl]acetonitrile 2-[[5-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile
Wiley ID 1454393