Vitas-M small molecule compound
ethyl 4-hydroxy-2-oxo-4-(trifluoromethyl)-6-(3,4,5-trimethoxyphenyl)hexahydropyrimidine-5-carboxylate
Catalog ID
STL090885
SMILES CCOC(=O)C1C(NC(=O)NC1(O)C(F)(F)F)c1cc(OC)c(c(c1)OC)OC
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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 C17H21F3N2O7 MW 422.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21F3N2O7/c1-5-29-14(23)11-12(21-15(24)22-16(11,25)17(18,19)20)8-6-9(26-2)13(28-4)10(7-8)27-3/h6-7,11-12,25H,5H2,1-4H3,(H2,21,22,24)InChIKey
WWJBPLZOMCCIMH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(NC(=O)NC1(C(F)(F)F)O)C2=CC(=C(C(=C2)OC)OC)OC
ETHYL4HYDROXY2OXO4(TRIFLUOROMETHYL)6(345TRIMETHOXYPHENYL)13DIAZINANE5CARBOXYLATE
ethyl4hydroxy2oxo4(trifluoromethyl)6(345trimethoxyphenyl)hexahydropyrimidine5carboxylate
InChI=1SC17H21F3N2O7c152914(23)1112(2115(24)2216(1125)17(1819)20)869(262)13(284)10(78)273h67111225H5H214H3(H2212224)
MFCD02250016
ZINC000008741771
ZINC000011859065
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