Vitas-M small molecule compound
ethyl 4-[4-(dimethylamino)phenyl]-6-hydroxy-1-methyl-2-oxo-6-(trifluoromethyl)hexahydropyrimidine-5-carboxylate
Catalog ID
STL090971
SMILES CCOC(=O)C1C(NC(=O)N(C1(O)C(F)(F)F)C)c1ccc(cc1)N(C)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 C17H22F3N3O4 MW 389.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22F3N3O4/c1-5-27-14(24)12-13(10-6-8-11(9-7-10)22(2)3)21-15(25)23(4)16(12,26)17(18,19)20/h6-9,12-13,26H,5H2,1-4H3,(H,21,25)InChIKey
PJERPWVXISOKSO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(NC(=O)N(C1(C(F)(F)F)O)C)C2=CC=C(C=C2)N(C)C
ETHYL(4S5R6R)4(4(DIMETHYLAMINO)PHENYL)6HYDROXY1METHYL2OXO6(TRIFLUOROMETHYL)HEXAHYDROPYRIMIDINE5CARBOXYLATE
ethyl4(4(dimethylamino)phenyl)6hydroxy1methyl2oxo6(trifluoromethyl)13diazinane5carboxylate
ethyl4(4(dimethylamino)phenyl)6hydroxy1methyl2oxo6(trifluoromethyl)hexahydropyrimidine5carboxylate
ETHYL4(4DIMETHYLAMINOPHENYL)6HYDROXY1METHYL2OXO6(TRIFLUOROMETHYL)13DIAZINANE5CARBOXYLATE
InChI=1SC17H22F3N3O4c152714(24)1213(106811(9710)22(2)3)2115(25)23(4)16(1226)17(1819)20h69121326H5H214H3(H2125)
MFCD02730739
ZINC000001016343
ZINC000017201487
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