EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:194772 - Ethyl 2-chloro-4-methyl-1,3-thiazole-5-carboxylate

ChEBI IDCHEBI:194772
ChEBI NameEthyl 2-chloro-4-methyl-1,3-thiazole-5-carboxylate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H8ClNO2S
Net Charge0
Average Mass205.666
Monoisotopic Mass204.99643
SMILESCCOC(=O)c1sc(Cl)nc1C
InChIInChI=1S/C7H8ClNO2S/c1-3-11-6(10)5-4(2)9-7(8)12-5/h3H2,1-2H3
InChIKeyVUARUZUFHDNJSY-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)
Ethyl 2-chloro-4-methyl-1,3-thiazole-5-carboxylate (CHEBI:194772) is a aromatic carboxylic acid (CHEBI:33859)
Ethyl 2-chloro-4-methyl-1,3-thiazole-5-carboxylate (CHEBI:194772) is a thiazoles (CHEBI:48901)
IUPAC Name 
ethyl 2-chloro-4-methyl-1,3-thiazole-5-carboxylate
Manual XrefsDatabases
517160ChemSpider