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CHEBI:114859 - 2-(3,5-dimethyl-1-pyrazolyl)-4-(4-hydroxyanilino)-5-pyrimidinecarboxylic acid ethyl ester

ChEBI IDCHEBI:114859
ChEBI Name2-(3,5-dimethyl-1-pyrazolyl)-4-(4-hydroxyanilino)-5-pyrimidinecarboxylic acid ethyl ester
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FormulaC18H19N5O3
Net Charge0
Average Mass353.382
Monoisotopic Mass353.14879
SMILESCCOC(=O)c1cnc(-n2nc(C)cc2C)nc1Nc1ccc(O)cc1
InChIInChI=1S/C18H19N5O3/c1-4-26-17(25)15-10-19-18(23-12(3)9-11(2)22-23)21-16(15)20-13-5-7-14(24)8-6-13/h5-10,24H,4H2,1-3H3,(H,19,20,21)
InChIKeyJLQSDPUKMIJEII-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-(3,5-dimethyl-1-pyrazolyl)-4-(4-hydroxyanilino)-5-pyrimidinecarboxylic acid ethyl ester (CHEBI:114859) is a pyrimidinecarboxylic acid (CHEBI:78574)
Manual XrefsDatabases
LSM-26321LINCS