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CHEBI:116625 - 2-(4-fluoroanilino)-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one

ChEBI IDCHEBI:116625
ChEBI Name2-(4-fluoroanilino)-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one
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DownloadsMolfile
FormulaC16H20FN3O
Net Charge0
Average Mass289.354
Monoisotopic Mass289.15904
SMILESCc1nc(Nc2ccc(F)cc2)nc(=O)c1CCC(C)C
InChIInChI=1S/C16H20FN3O/c1-10(2)4-9-14-11(3)18-16(20-15(14)21)19-13-7-5-12(17)6-8-13/h5-8,10H,4,9H2,1-3H3,(H2,18,19,20,21)
InChIKeyVGLRQUXOPQEKQZ-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
2-(4-fluoroanilino)-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one (CHEBI:116625) is a substituted aniline (CHEBI:48975)
Manual XrefsDatabases
LSM-28080LINCS