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acetamide, N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[[4-(2-propenyl)-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID Wn9563kvU9
InChI InChI=1S/C18H14ClF3N4OS2/c1-2-7-26-16(14-4-3-8-28-14)24-25-17(26)29-10-15(27)23-13-9-11(18(20,21)22)5-6-12(13)19/h2-6,8-9H,1,7,10H2,(H,23,27)
InChIKey ATGFKGYKRXODJW-UHFFFAOYSA-N
Mol Weight 458.91 g/mol
Molecular Formula C18H14ClF3N4OS2
Exact Mass 458.024966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eiy9RgZcJ2w
Name 2-[[4-allyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
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Formula C18H14ClF3N4OS2
InChI InChI=1S/C18H14ClF3N4OS2/c1-2-7-26-16(14-4-3-8-28-14)24-25-17(26)29-10-15(27)23-13-9-11(18(20,21)22)5-6-12(13)19/h2-6,8-9H,1,7,10H2,(H,23,27)
InChIKey ATGFKGYKRXODJW-UHFFFAOYSA-N
Molecular Weight 458.905 g/mol
SMILES N(c1cc(C(F)(F)F)ccc1Cl)C(CSc1[n](c(nn1)-c1sccc1)CC=C)=O
SPLASH splash10-0006-5940100000-49543d57d816dac7799e
Synonyms 2-[[4-allyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-[(4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]acetamide
Wiley ID 1462589