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4-Methyl-5-(phenylcarbamoyl)-2-[[3,3,3-trifluoro-2-(trifluoromethyl)propanoyl]amino]thiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID 4TKRQC1EZ7k
InChI InChI=1S/C19H16F6N2O4S/c1-3-31-17(30)11-9(2)12(14(28)26-10-7-5-4-6-8-10)32-16(11)27-15(29)13(18(20,21)22)19(23,24)25/h4-8,13H,3H2,1-2H3,(H,26,28)(H,27,29)
InChIKey HFOISKXWWYCINC-UHFFFAOYSA-N
Mol Weight 482.4 g/mol
Molecular Formula C19H16F6N2O4S
Exact Mass 482.073497 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AEWdonJr4by
Name 4-Methyl-5-(phenylcarbamoyl)-2-[[3,3,3-trifluoro-2-(trifluoromethyl)propanoyl]amino]thiophene-3-carboxylic acid ethyl ester
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Formula C19H16F6N2O4S
InChI InChI=1S/C19H16F6N2O4S/c1-3-31-17(30)11-9(2)12(14(28)26-10-7-5-4-6-8-10)32-16(11)27-15(29)13(18(20,21)22)19(23,24)25/h4-8,13H,3H2,1-2H3,(H,26,28)(H,27,29)
InChIKey HFOISKXWWYCINC-UHFFFAOYSA-N
Molecular Weight 482.397 g/mol
SMILES N(C(c1c(c(c(s1)NC(C(C(F)(F)F)C(F)(F)F)=O)C(=O)OCC)C)=O)c1ccccc1
SPLASH splash10-00kf-9615000000-45f109fe016134aed8ad
Synonyms 5-[anilino(oxo)methyl]-4-methyl-2-[[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl]amino]-3-thiophenecarboxylic acid ethyl ester Ethyl 4-methyl-5-(phenylcarbamoyl)-2-[[3,3,3-trifluoro-2-(trifluoromethyl)propanoyl]amino]thiophene-3-carboxylate Ethyl 4-methyl-5-(phenylcarbamoyl)-2-[[3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoyl]amino]thiophene-3-carboxylate
Wiley ID 1442320