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2-(5-Chloranyl-3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide
SpectraBase Compound ID BPqvjMKpl1r
InChI InChI=1S/C17H13ClF3N3OS/c1-9-13(7-22)16(23-10(2)15(9)18)26-8-14(25)24-12-5-3-4-11(6-12)17(19,20)21/h3-6H,8H2,1-2H3,(H,24,25)
InChIKey OESCXYUUHLDODJ-UHFFFAOYSA-N
Mol Weight 399.82 g/mol
Molecular Formula C17H13ClF3N3OS
Exact Mass 399.041995 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9pwF2BDrmvk
Name 2-(5-Chloranyl-3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide
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Formula C17H13ClF3N3OS
InChI InChI=1S/C17H13ClF3N3OS/c1-9-13(7-22)16(23-10(2)15(9)18)26-8-14(25)24-12-5-3-4-11(6-12)17(19,20)21/h3-6H,8H2,1-2H3,(H,24,25)
InChIKey OESCXYUUHLDODJ-UHFFFAOYSA-N
Molecular Weight 399.819 g/mol
SMILES N(C(CSc1c(c(c(c(C)n1)Cl)C)C#N)=O)c1cc(C(F)(F)F)ccc1
SPLASH splash10-03di-1490000000-fb0a02b0f812d44c0d68
Synonyms 2-(5-Chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide 2-[(5-chloro-3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide 2-[(5-chloro-3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide 2-[(5-chloro-3-cyano-4,6-dimethyl-2-pyridyl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide Acetamide, 2-(5-chloro-3-cyano-4,6-dimethylpyridin-2-ylsulfanyl)-N-(3-trifluoromethylphenyl)-
Wiley ID 1441991