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2-[4-amino-5-sulfanylidene-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide
SpectraBase Compound ID Umt6qKlGp5
InChI InChI=1S/C12H12F3N5O2S/c1-22-8-5-3-2-4-7(8)17-9(21)6-19-11(23)20(16)10(18-19)12(13,14)15/h2-5H,6,16H2,1H3,(H,17,21)
InChIKey YQFYULBNYYXVHF-UHFFFAOYSA-N
Mol Weight 347.32 g/mol
Molecular Formula C12H12F3N5O2S
Exact Mass 347.06638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I1m2SYnAzYS
Name 2-[4-amino-5-sulfanylidene-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide
Alternate Name(s) 2-[4-amino-5-thioxo-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide 2-[4-amino-5-thioxo-3-(trifluoromethyl)-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide 2-[4-azanyl-5-sulfanylidene-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)ethanamide
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Formula C12H12F3N5O2S
InChI InChI=1S/C12H12F3N5O2S/c1-22-8-5-3-2-4-7(8)17-9(21)6-19-11(23)20(16)10(18-19)12(13,14)15/h2-5H,6,16H2,1H3,(H,17,21)
InChIKey YQFYULBNYYXVHF-UHFFFAOYSA-N
Molecular Weight 347.316 g/mol
SMILES N(C(CN1N=C(N(C1=S)N)C(F)(F)F)=O)c1c(OC)cccc1
SPLASH splash10-0100-8910000000-68e2e3a7c8a37876d2b0
Wiley ID 1511165