Vitas-M small molecule compound
5-{[4,5-dimethyl-3-oxido-1-(1H-1,2,4-triazol-5-yl)-1H-imidazol-2-yl](4-hydroxy-3-methoxyphenyl)methyl}-2-hydroxypyrimidine-4,6(1H,5H)-dione
Catalog ID
STL494206
SMILES COc1cc(ccc1O)C(c1[n+]([O-])c(c(n1c1[nH]ncn1)C)C)C1C(=O)NC(=NC1=O)O
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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 C19H19N7O6 MW 441.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N7O6/c1-8-9(2)26(31)17(25(8)18-20-7-21-24-18)13(10-4-5-11(27)12(6-10)32-3)14-15(28)22-19(30)23-16(14)29/h4-7,13-14,27H,1-3H3,(H,20,21,24)(H2,22,23,28,29,30)InChIKey
KWVJTOJYSHJQOD-UHFFFAOYSA-NSynonyms
5((45dimethyl3oxido1(1H124triazol5yl)1Himidazol2yl)(4hydroxy3methoxyphenyl)methyl)2hydroxypyrimidine46(1H5H)dione
COc1cc(ccc1O)C(c1(n+)((O))c(c(n1c1(nH)ncn1)C)C)C1C(=O)NC(=NC1=O)O
MFCD30716257
ZINC000409415470
ZINC000409415471
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