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3-(3,4-dimethylphenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)amino]-6-oxo-4,5-dihydropyrimidine-4-carboxylic acid
SpectraBase Compound ID D6OpBb8dKNc
InChI InChI=1S/C19H21N5O3/c1-10-5-6-14(7-11(10)2)24-15(17(26)27)9-16(25)22-19(24)23-18-20-12(3)8-13(4)21-18/h5-8,15H,9H2,1-4H3,(H,26,27)(H,20,21,22,23,25)
InChIKey NBVXJMFETHPWHP-UHFFFAOYSA-N
Mol Weight 367.41 g/mol
Molecular Formula C19H21N5O3
Exact Mass 367.16444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DchlvnrMcg
Name 3-(3,4-dimethylphenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)amino]-6-oxo-4,5-dihydropyrimidine-4-carboxylic acid
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Formula C19H21N5O3
InChI InChI=1S/C19H21N5O3/c1-10-5-6-14(7-11(10)2)24-15(17(26)27)9-16(25)22-19(24)23-18-20-12(3)8-13(4)21-18/h5-8,15H,9H2,1-4H3,(H,26,27)(H,20,21,22,23,25)
InChIKey NBVXJMFETHPWHP-UHFFFAOYSA-N
Molecular Weight 367.409 g/mol
SMILES OC(C1N(C(=NC(C1)=O)Nc1nc(C)cc(n1)C)c1cc(C)c(cc1)C)=O
SPLASH splash10-0002-9300000000-4aa5152a3884eb760094
Synonyms 3-(3,4-dimethylphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-keto-4,5-dihydropyrimidine-4-carboxylic acid 3-(3,4-dimethylphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxidanylidene-4,5-dihydropyrimidine-4-carboxylic acid 3-(3,4-dimethylphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxo-4,5-dihydropyrimidine-4-carboxylic acid
Wiley ID 1445281