Vitas-M small molecule compound

ethyl 6-(chloromethyl)-4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK400034
SMILES CCOC(=O)C1=C(CCl)NC(=O)NC1c1cn(nc1C)CC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C14H19ClN4O3 MW 326.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19ClN4O3/c1-4-19-7-9(8(3)18-19)12-11(13(20)22-5-2)10(6-15)16-14(21)17-12/h7,12H,4-6H2,1-3H3,(H2,16,17,21)
InChIKey
QPBHNSYEZAUEEK-UHFFFAOYSA-N
Synonyms

CCN1C=C(C(=N1)C)C2C(=C(NC(=O)N2)CCl)C(=O)OCC
ethyl6(chloromethyl)4(1ethyl3methyl1Hpyrazol4yl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6(chloromethyl)4(1ethyl3methylpyrazol4yl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC14H19ClN4O3c141979(8(3)1819)1211(13(20)2252)10(615)1614(21)1712h712H46H213H3(H2161721)
MFCD08696341
ZINC000020312953
ZINC000020312958

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.