Vitas-M small molecule compound
5-[(1-benzyl-4,5-dimethyl-3-oxido-1H-imidazol-2-yl)(5-phenyl-1H-pyrazol-4-yl)methyl]-2,2-dimethyl-1,3-dioxane-4,6-dione
Catalog ID
STL494589
SMILES O=C1OC(C)(C)OC(=O)C1C(c1[n+]([O-])c(c(n1Cc1ccccc1)C)C)c1cn[nH]c1c1ccccc1
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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 C28H28N4O5 MW 500.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O5/c1-17-18(2)32(35)25(31(17)16-19-11-7-5-8-12-19)22(23-26(33)36-28(3,4)37-27(23)34)21-15-29-30-24(21)20-13-9-6-10-14-20/h5-15,22-23H,16H2,1-4H3,(H,29,30)InChIKey
GRDOBPWEQMJVQS-UHFFFAOYSA-NSynonyms
1benzyl2((22dimethyl46dioxo13dioxan5yl)(3phenyl1Hpyrazol4yl)methyl)45dimethyl1Himidazole3oxide
5((1benzyl45dimethyl3oxido1Himidazol2yl)(5phenyl1Hpyrazol4yl)methyl)22dimethyl13dioxane46dione
MFCD30716493
O=C1OC(C)(C)OC(=O)C1C(c1(n+)((O))c(c(n1Cc1ccccc1)C)C)c1c(nH)nc1c1ccccc1
O=C1OC(C)(C)OC(=O)C1C(c1(n+)((O))c(c(n1Cc1ccccc1)C)C)c1cn(nH)c1c1ccccc1
ZINC000263587413
ZINC000263587414
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