Vitas-M small molecule compound
ethyl 6-hydroxy-1-methyl-2-oxo-6-(trifluoromethyl)-4-[4-(trifluoromethyl)phenyl]hexahydropyrimidine-5-carboxylate
Catalog ID
STL090961
SMILES CCOC(=O)C1C(NC(=O)N(C1(O)C(F)(F)F)C)c1ccc(cc1)C(F)(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 C16H16F6N2O4 MW 414.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16F6N2O4/c1-3-28-12(25)10-11(8-4-6-9(7-5-8)15(17,18)19)23-13(26)24(2)14(10,27)16(20,21)22/h4-7,10-11,27H,3H2,1-2H3,(H,23,26)InChIKey
VYLAJEIUSJLNLN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(NC(=O)N(C1(C(F)(F)F)O)C)C2=CC=C(C=C2)C(F)(F)F
ETHYL6HYDROXY1METHYL2OXO6(TRIFLUOROMETHYL)4(4(TRIFLUOROMETHYL)PHENYL)13DIAZINANE5CARBOXYLATE
ethyl6hydroxy1methyl2oxo6(trifluoromethyl)4(4(trifluoromethyl)phenyl)hexahydropyrimidine5carboxylate
InChI=1SC16H16F6N2O4c132812(25)1011(8469(758)15(1718)19)2313(26)24(2)14(1027)16(2021)22h47101127H3H212H3(H2326)
MFCD02730764
ZINC000001016350
ZINC000033540739
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