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CHEBI:107233 - 2-[[(4-bromo-1-ethyl-3-pyrazolyl)-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester

ChEBI IDCHEBI:107233
ChEBI Name2-[[(4-bromo-1-ethyl-3-pyrazolyl)-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester
Stars
DownloadsMolfile
FormulaC15H18BrN3O3S
Net Charge0
Average Mass400.298
Monoisotopic Mass399.02522
SMILESCCOC(=O)c1c(NC(=O)c2nn(CC)cc2Br)sc(C)c1C
InChIInChI=1S/C15H18BrN3O3S/c1-5-19-7-10(16)12(18-19)13(20)17-14-11(15(21)22-6-2)8(3)9(4)23-14/h7H,5-6H2,1-4H3,(H,17,20)
InChIKeyVYDWDSBKBDEKNA-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-[[(4-bromo-1-ethyl-3-pyrazolyl)-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester (CHEBI:107233) is a thiophenecarboxylic acid (CHEBI:48436)
Manual XrefsDatabases
LSM-18587LINCS