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CHEBI:105294 - 2-[(5-chloro-2-thiophenyl)-oxomethyl]imino-3,4-dimethyl-5-thiazolecarboxylic acid ethyl ester

ChEBI IDCHEBI:105294
ChEBI Name2-[(5-chloro-2-thiophenyl)-oxomethyl]imino-3,4-dimethyl-5-thiazolecarboxylic acid ethyl ester
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DownloadsMolfile
FormulaC13H13ClN2O3S2
Net Charge0
Average Mass344.845
Monoisotopic Mass344.00561
SMILESCCOC(=O)c1sc(=NC(=O)c2ccc(Cl)s2)n(C)c1C
InChIInChI=1S/C13H13ClN2O3S2/c1-4-19-12(18)10-7(2)16(3)13(21-10)15-11(17)8-5-6-9(14)20-8/h5-6H,4H2,1-3H3
InChIKeySYMZLNUWBPNEIT-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-[(5-chloro-2-thiophenyl)-oxomethyl]imino-3,4-dimethyl-5-thiazolecarboxylic acid ethyl ester (CHEBI:105294) is a aromatic carboxylic acid (CHEBI:33859)
2-[(5-chloro-2-thiophenyl)-oxomethyl]imino-3,4-dimethyl-5-thiazolecarboxylic acid ethyl ester (CHEBI:105294) is a thiazoles (CHEBI:48901)
Manual XrefsDatabases
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