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CHEBI:109607 - 4,5-dichloro-3-isothiazolecarboxylic acid [1-(2-furanylmethylamino)-1-oxopropan-2-yl] ester

ChEBI IDCHEBI:109607
ChEBI Name4,5-dichloro-3-isothiazolecarboxylic acid [1-(2-furanylmethylamino)-1-oxopropan-2-yl] ester
Stars
DownloadsMolfile
FormulaC12H10Cl2N2O4S
Net Charge0
Average Mass349.195
Monoisotopic Mass347.97383
SMILESCC(OC(=O)c1nsc(Cl)c1Cl)C(=O)NCc1ccco1
InChIInChI=1S/C12H10Cl2N2O4S/c1-6(11(17)15-5-7-3-2-4-19-7)20-12(18)9-8(13)10(14)21-16-9/h2-4,6H,5H2,1H3,(H,15,17)
InChIKeyXWFUUIKRNQMEEN-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)
4,5-dichloro-3-isothiazolecarboxylic acid [1-(2-furanylmethylamino)-1-oxopropan-2-yl] ester (CHEBI:109607) is a aromatic carboxylic acid (CHEBI:33859)
4,5-dichloro-3-isothiazolecarboxylic acid [1-(2-furanylmethylamino)-1-oxopropan-2-yl] ester (CHEBI:109607) is a thiazoles (CHEBI:48901)
Manual XrefsDatabases
LSM-21035LINCS