Vitas-M small molecule compound
5-{(4-hydroxy-3,5-dimethoxyphenyl)[1-(2-hydroxyethyl)-4,5-dimethyl-3-oxido-1H-imidazol-2-yl]methyl}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL569291
SMILES OCCn1c(C)c([n+](c1C(C1C(=O)NC(=O)NC1=O)c1cc(OC)c(c(c1)OC)O)[O-])C
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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 C20H24N4O8 MW 448.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O8/c1-9-10(2)24(30)19(23(9)5-6-25)14(15-17(27)21-20(29)22-18(15)28)11-7-12(31-3)16(26)13(8-11)32-4/h7-8,14-15,25-26H,5-6H2,1-4H3,(H2,21,22,27,28,29)InChIKey
BPKCYUBOTXIOHB-UHFFFAOYSA-NSynonyms
128963438
2((4hydroxy35dimethoxyphenyl)(246trioxohexahydropyrimidin5yl)methyl)1(2hydroxyethyl)45dimethyl1Himidazole3oxide
5((4hydroxy35dimethoxyphenyl)(1(2hydroxyethyl)45dimethyl3oxido1Himidazol2yl)methyl)pyrimidine246(1H3H5H)trione
5((4hydroxy35dimethoxyphenyl)(1(2hydroxyethyl)45dimethyl3oxidoimidazol3ium2yl)methyl)13diazinane246trione
InChI=1SC20H24N4O8c1910(2)24(30)19(23(9)5625)14(1517(27)2120(29)2218(15)28)11712(313)16(26)13(811)324h7814152526H56H214H3(H22122272829)
MFCD32654273
OCCn1c(C)c((n+)(c1C(C1C(=O)NC(=O)NC1=O)c1cc(OC)c(c(c1)OC)O)(O))C
ZINC000524735170
ZINC000524735171
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