Vitas-M small molecule compound
ethyl 6-[1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-1H-pyrazol-4-yl]-4-hydroxy-2-oxo-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate
Catalog ID
STL090897
SMILES CCOC(=O)C1C(NC(=O)NC1(O)C(F)(F)F)c1cn(nc1C)c1nc(C)cc(n1)C
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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 C18H21F3N6O4 MW 442.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21F3N6O4/c1-5-31-14(28)12-13(24-16(29)25-17(12,30)18(19,20)21)11-7-27(26-10(11)4)15-22-8(2)6-9(3)23-15/h6-7,12-13,30H,5H2,1-4H3,(H2,24,25,29)InChIKey
OFEIUHZNGSZWKK-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(NC(=O)NC1(C(F)(F)F)O)C2=CN(N=C2C)C3=NC(=CC(=N3)C)C
ethyl6(1(46dimethylpyrimidin2yl)3methyl1Hpyrazol4yl)4hydroxy2oxo4(trifluoromethyl)hexahydropyrimidine5carboxylate
ETHYL6(1(46DIMETHYLPYRIMIDIN2YL)3METHYLPYRAZOL4YL)4HYDROXY2OXO4(TRIFLUOROMETHYL)13DIAZINANE5CARBOXYLATE
InChI=1SC18H21F3N6O4c153114(28)1213(2416(29)2517(1230)18(1920)21)11727(2610(11)4)15228(2)69(3)2315h67121330H5H214H3(H2242529)
MFCD03268725
ZINC000001480258
ZINC000034932034
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