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5-Acetyl-2-(3-bromo-benzoylamino)-4-methyl-thiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID 8ahXb8rUb68
InChI InChI=1S/C17H16BrNO4S/c1-4-23-17(22)13-9(2)14(10(3)20)24-16(13)19-15(21)11-6-5-7-12(18)8-11/h5-8H,4H2,1-3H3,(H,19,21)
InChIKey LVRGSAWBNSGXKN-UHFFFAOYSA-N
Mol Weight 410.28 g/mol
Molecular Formula C17H16BrNO4S
Exact Mass 408.998342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKfghUMBPDW
Name 5-Acetyl-2-(3-bromo-benzoylamino)-4-methyl-thiophene-3-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16BrNO4S
InChI InChI=1S/C17H16BrNO4S/c1-4-23-17(22)13-9(2)14(10(3)20)24-16(13)19-15(21)11-6-5-7-12(18)8-11/h5-8H,4H2,1-3H3,(H,19,21)
InChIKey LVRGSAWBNSGXKN-UHFFFAOYSA-N
Molecular Weight 410.282 g/mol
SMILES N(c1c(c(C)c(s1)C(=O)C)C(=O)OCC)C(c1cc(Br)ccc1)=O
SPLASH splash10-0540-3900100000-3616f7be55fc40427ea8
Synonyms 5-Acetyl-2-[[(3-bromophenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester Ethyl 2-[(3-bromophenyl)carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Ethyl 5-acetyl-2-[(3-bromobenzoyl)amino]-4-methyl-3-thiophenecarboxylate Ethyl 5-acetyl-2-[(3-bromobenzoyl)amino]-4-methyl-thiophene-3-carboxylate Ethyl 5-acetyl-2-[(3-bromobenzoyl)amino]-4-methylthiophene-3-carboxylate
Wiley ID 1461192