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5-Acetyl-4-methyl-2-(2-methyl-3-nitro-benzoylamino)-thiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID KEaotZAM7S4
InChI InChI=1S/C18H18N2O6S/c1-5-26-18(23)14-10(3)15(11(4)21)27-17(14)19-16(22)12-7-6-8-13(9(12)2)20(24)25/h6-8H,5H2,1-4H3,(H,19,22)
InChIKey OBAWHMDOCUIRTB-UHFFFAOYSA-N
Mol Weight 390.41 g/mol
Molecular Formula C18H18N2O6S
Exact Mass 390.088557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ybQec0SduN
Name 5-Acetyl-4-methyl-2-(2-methyl-3-nitro-benzoylamino)-thiophene-3-carboxylic acid ethyl ester
Alternate Name(s) 5-Acetyl-4-methyl-2-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester Ethyl 5-acetyl-4-methyl-2-[(2-methyl-3-nitro-benzoyl)amino]thiophene-3-carboxylate Ethyl 5-acetyl-4-methyl-2-[(2-methyl-3-nitrobenzoyl)amino]-3-thiophenecarboxylate Ethyl 5-ethanoyl-4-methyl-2-[(2-methyl-3-nitro-phenyl)carbonylamino]thiophene-3-carboxylate Ethyl 5-acetyl-4-methyl-2-[(2-methyl-3-nitrobenzoyl)amino]thiophene-3-carboxylate
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Formula C18H18N2O6S
InChI InChI=1S/C18H18N2O6S/c1-5-26-18(23)14-10(3)15(11(4)21)27-17(14)19-16(22)12-7-6-8-13(9(12)2)20(24)25/h6-8H,5H2,1-4H3,(H,19,22)
InChIKey OBAWHMDOCUIRTB-UHFFFAOYSA-N
Molecular Weight 390.410 g/mol
SMILES N(c1c(c(C)c(s1)C(=O)C)C(=O)OCC)C(c1c(c(N(=O)=O)ccc1)C)=O
SPLASH splash10-03di-2901000000-8f742c1c1aad79f45012
Wiley ID 1462552