Vitas-M small molecule compound
4-[(E)-2-(4-methoxy-3-nitrophenyl)ethenyl]-6-(trifluoromethyl)pyrimidin-2(1H)-one
Catalog ID
STL388568
SMILES COc1ccc(cc1[N+](=O)[O-])/C=C/c1nc(=O)[nH]c(c1)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 C14H10F3N3O4 MW 341.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H10F3N3O4/c1-24-11-5-3-8(6-10(11)20(22)23)2-4-9-7-12(14(15,16)17)19-13(21)18-9/h2-7H,1H3,(H,18,19,21)/b4-2+InChIKey
YQFPVNYRLXPUSH-DUXPYHPUSA-NSynonyms
4((E)2(4METHOXY3NITROPHENYL)ETHENYL)6(TRIFLUOROMETHYL)1HPYRIMIDIN2ONE
4((E)2(4methoxy3nitrophenyl)ethenyl)6(trifluoromethyl)pyrimidin2(1H)one
COC1=C(C=C(C=C1)C=CC2=NC(=O)NC(=C2)C(F)(F)F)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C=Cc1nc(=O)(nH)c(c1)C(F)(F)F
InChI=1SC14H10F3N3O4c12411538(610(11)20(22)23)249712(14(1516)17)1913(21)189h27H1H3(H181921)b42+
MFCD07178446
ZINC000004809855
ZINC4809855
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