Vitas-M small molecule compound
ethyl 6-hydroxy-1-methyl-2-oxo-4-(thiophen-2-yl)-6-(trifluoromethyl)hexahydropyrimidine-5-carboxylate
Catalog ID
STL090974
SMILES CCOC(=O)C1C(NC(=O)N(C1(O)C(F)(F)F)C)c1cccs1
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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 C13H15F3N2O4S MW 352.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15F3N2O4S/c1-3-22-10(19)8-9(7-5-4-6-23-7)17-11(20)18(2)12(8,21)13(14,15)16/h4-6,8-9,21H,3H2,1-2H3,(H,17,20)InChIKey
YOLOFISUIIPWFO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(NC(=O)N(C1(C(F)(F)F)O)C)C2=CC=CS2
ETHYL6HYDROXY1METHYL2OXO4(2THIENYL)6(TRIFLUOROMETHYL)HEXAHYDRO5PYRIMIDINECARBOXYLATE
ethyl6hydroxy1methyl2oxo4(thiophen2yl)6(trifluoromethyl)hexahydropyrimidine5carboxylate
ETHYL6HYDROXY1METHYL2OXO4THIOPHEN2YL6(TRIFLUOROMETHYL)13DIAZINANE5CARBOXYLATE
InChI=1SC13H15F3N2O4Sc132210(19)89(7546237)1711(20)18(2)12(821)13(1415)16h468921H3H212H3(H1720)
MFCD02730748
ZINC000004269788
ZINC000011859217
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