Vitas-M small molecule compound
ethyl 6-(4-fluorophenyl)-4-hydroxy-2-thioxo-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate
Catalog ID
STL091019
SMILES CCOC(=O)C1C(NC(=S)NC1(O)C(F)(F)F)c1ccc(cc1)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 C14H14F4N2O3S MW 366.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14F4N2O3S/c1-2-23-11(21)9-10(7-3-5-8(15)6-4-7)19-12(24)20-13(9,22)14(16,17)18/h3-6,9-10,22H,2H2,1H3,(H2,19,20,24)InChIKey
SYRPPKBGHHVDAO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(NC(=S)NC1(C(F)(F)F)O)C2=CC=C(C=C2)F
ETHYL(4S5R6S)6(4FLUOROPHENYL)4HYDROXY2THIOXO4(TRIFLUOROMETHYL)HEXAHYDROPYRIMIDINE5CARBOXYLATE
ETHYL6(4FLUOROPHENYL)4HYDROXY2SULFANYLIDENE4(TRIFLUOROMETHYL)13DIAZINANE5CARBOXYLATE
ethyl6(4fluorophenyl)4hydroxy2thioxo4(trifluoromethyl)hexahydropyrimidine5carboxylate
InChI=1SC14H14F4N2O3Sc122311(21)910(7358(15)647)1912(24)2013(922)14(1617)18h3691022H2H21H3(H2192024)
MFCD02332310
ZINC000001317693
ZINC000011691778
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