Vitas-M small molecule compound

ethyl 6-hydroxy-1-methyl-2-oxo-4-phenyl-6-(trifluoromethyl)hexahydropyrimidine-5-carboxylate

Catalog ID
STL090958
SMILES CCOC(=O)C1C(NC(=O)N(C1(O)C(F)(F)F)C)c1ccccc1

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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 C15H17F3N2O4 MW 346.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17F3N2O4/c1-3-24-12(21)10-11(9-7-5-4-6-8-9)19-13(22)20(2)14(10,23)15(16,17)18/h4-8,10-11,23H,3H2,1-2H3,(H,19,22)
InChIKey
GRONKVZAUHQTIG-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1C(NC(=O)N(C1(C(F)(F)F)O)C)C2=CC=CC=C2
ETHYL6HYDROXY1METHYL2OXO4PHENYL6(TRIFLUOROMETHYL)13DIAZINANE5CARBOXYLATE
ethyl6hydroxy1methyl2oxo4phenyl6(trifluoromethyl)hexahydropyrimidine5carboxylate
InChI=1SC15H17F3N2O4c132412(21)1011(9754689)1913(22)20(2)14(1023)15(1617)18h48101123H3H212H3(H1922)
MFCD03066492
ZINC000004184404
ZINC000013114372

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Available files

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