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CHEBI:117151 - 6-(2-chlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester

ChEBI IDCHEBI:117151
ChEBI Name6-(2-chlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester
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DownloadsMolfile
FormulaC17H21ClN2O3
Net Charge0
Average Mass336.819
Monoisotopic Mass336.12407
SMILESCC1=C(C(=O)OCC(C)C)C(c2ccccc2Cl)NC(=O)N1C
InChIInChI=1S/C17H21ClN2O3/c1-10(2)9-23-16(21)14-11(3)20(4)17(22)19-15(14)12-7-5-6-8-13(12)18/h5-8,10,15H,9H2,1-4H3,(H,19,22)
InChIKeyWCWVXPGDIKVTPC-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)
6-(2-chlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester (CHEBI:117151) is a pyrimidinecarboxylic acid (CHEBI:78574)
Manual XrefsDatabases
LSM-28600LINCS