Vitas-M small molecule compound
ethyl 4-(3,4-difluorophenyl)-6-hydroxy-1-methyl-2-oxo-6-(trifluoromethyl)hexahydropyrimidine-5-carboxylate
Catalog ID
STL090962
SMILES CCOC(=O)C1C(NC(=O)N(C1(O)C(F)(F)F)C)c1ccc(c(c1)F)F
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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 C15H15F5N2O4 MW 382.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15F5N2O4/c1-3-26-12(23)10-11(7-4-5-8(16)9(17)6-7)21-13(24)22(2)14(10,25)15(18,19)20/h4-6,10-11,25H,3H2,1-2H3,(H,21,24)InChIKey
ZQZSZUNZPFQOAY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(NC(=O)N(C1(C(F)(F)F)O)C)C2=CC(=C(C=C2)F)F
ETHYL(4S5R6R)4(34DIFLUOROPHENYL)6HYDROXY1METHYL2OXO6(TRIFLUOROMETHYL)HEXAHYDROPYRIMIDINE5CARBOXYLATE
ETHYL4(34DIFLUOROPHENYL)6HYDROXY1METHYL2OXO6(TRIFLUOROMETHYL)13DIAZINANE5CARBOXYLATE
ethyl4(34difluorophenyl)6hydroxy1methyl2oxo6(trifluoromethyl)hexahydropyrimidine5carboxylate
InChI=1SC15H15F5N2O4c132612(23)1011(7458(16)9(17)67)2113(24)22(2)14(1025)15(1819)20h46101125H3H212H3(H2124)
MFCD02730825
ZINC000000951760
ZINC000011859235
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