Vitas-M small molecule compound
5-acetyl-6-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
Catalog ID
STL090852
SMILES COc1cc(ccc1OCc1ccc(cc1)Cl)C1NC(=O)NC(C1C(=O)C)(O)C(F)(F)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 C21H20ClF3N2O5 MW 472.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClF3N2O5/c1-11(28)17-18(26-19(29)27-20(17,30)21(23,24)25)13-5-8-15(16(9-13)31-2)32-10-12-3-6-14(22)7-4-12/h3-9,17-18,30H,10H2,1-2H3,(H2,26,27,29)InChIKey
BRNRVIBSNAYTLG-UHFFFAOYSA-NSynonyms
1005264-60-71005264607
5acetyl6(4((4chlorobenzyl)oxy)3methoxyphenyl)4hydroxy4(trifluoromethyl)tetrahydropyrimidin2(1H)one
5ACETYL6(4((4CHLOROPHENYL)METHOXY)3METHOXYPHENYL)4HYDROXY4(TRIFLUOROMETHYL)13DIAZINAN2ONE
CC(=O)C1C(NC(=O)NC1(C(F)(F)F)O)C2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)OC
InChI=1SC21H20ClF3N2O5c111(28)1718(2619(29)2720(1730)21(2324)25)135815(16(913)312)3210123614(22)7412h39171830H10H212H3(H2262729)
MFCD03132986
ZINC000012377572
ZINC000245245202
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