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2-[[1-carbomethoxy-2,2,2-trifluoro-1-[(2-phenylacetyl)amino]ethyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid methyl ester
SpectraBase Compound ID 7u9R6HtlKNw
InChI InChI=1S/C21H23F3N2O5S/c1-5-14-12(2)32-17(16(14)18(28)30-3)26-20(19(29)31-4,21(22,23)24)25-15(27)11-13-9-7-6-8-10-13/h6-10,26H,5,11H2,1-4H3,(H,25,27)
InChIKey LTVWVAKDZJAHAB-UHFFFAOYSA-N
Mol Weight 472.48 g/mol
Molecular Formula C21H23F3N2O5S
Exact Mass 472.127978 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BN8WrkPYABc
Name 2-[[1-carbomethoxy-2,2,2-trifluoro-1-[(2-phenylacetyl)amino]ethyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid methyl ester
Alternate Name(s) 4-Ethyl-5-methyl-2-[[1,1,1-trifluoro-3-methoxy-3-oxo-2-[(1-oxo-2-phenylethyl)amino]propan-2-yl]amino]-3-thiophenecarboxylic acid methyl ester Methyl 4-ethyl-5-methyl-2-[[1,1,1-trifluoro-3-methoxy-3-oxo-2-[(2-phenylacetyl)amino]propan-2-yl]amino]thiophene-3-carboxylate Methyl 4-ethyl-5-methyl-2-[[1,1,1-tris(fluoranyl)-3-methoxy-3-oxidanylidene-2-(2-phenylethanoylamino)propan-2-yl]amino]thiophene-3-carboxylate Methyl 4-ethyl-5-methyl-2-[[2,2,2-trifluoro-1-methoxycarbonyl-1-[(2-phenylacetyl)amino]ethyl]amino]thiophene-3-carboxylate
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Formula C21H23F3N2O5S
InChI InChI=1S/C21H23F3N2O5S/c1-5-14-12(2)32-17(16(14)18(28)30-3)26-20(19(29)31-4,21(22,23)24)25-15(27)11-13-9-7-6-8-10-13/h6-10,26H,5,11H2,1-4H3,(H,25,27)
InChIKey LTVWVAKDZJAHAB-UHFFFAOYSA-N
Molecular Weight 472.479 g/mol
SMILES N(c1c(c(CC)c(s1)C)C(=O)OC)C(C(F)(F)F)(NC(=O)Cc1ccccc1)C(=O)OC
SPLASH splash10-0006-9541100000-acf2ccf60918ab9881dd
Wiley ID 1442304