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

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ChEBI Name 2-(3,5-dimethyl-1-pyrazolyl)-4-(4-hydroxyanilino)-5-pyrimidinecarboxylic acid ethyl ester
ChEBI ID CHEBI:114859
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C18H19N5O3
Net Charge 0
Average Mass 353.376
Monoisotopic Mass 353.14879
InChI InChI=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)
InChIKey JLQSDPUKMIJEII-UHFFFAOYSA-N
SMILES CCOC(=O)C1=CN=C(N=C1NC2=CC=C(C=C2)O)N3C(=CC(=N3)C)C
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 2-(3,5-dimethyl-1-pyrazolyl)-4-(4-hydroxyanilino)-5-pyrimidinecarboxylic acid ethyl ester (CHEBI:114859) is a pyrimidinecarboxylic acid (CHEBI:78574)
Manual Xref Database
LSM-26321 LINCS
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