Vitas-M small molecule compound
4-[(E)-{2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-9-ium-7-yl)acetyl]hydrazinylidene}methyl]-2-ethoxyphenolate
Catalog ID
STL149338
SMILES CCOc1cc(/C=N/NC(=O)Cn2c[nH+]c3c2c(=O)n(C)c(=O)n3C)ccc1[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 C18H20N6O5 MW 400.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O5/c1-4-29-13-7-11(5-6-12(13)25)8-20-21-14(26)9-24-10-19-16-15(24)17(27)23(3)18(28)22(16)2/h5-8,10,25H,4,9H2,1-3H3,(H,21,26)/b20-8+InChIKey
KAJLORMDUJXJHX-DNTJNYDQSA-NSynonyms
497228-36-14((E)(2((13dimethyl26dioxo1236tetrahydro7Hpurin9ium7yl)acetyl)hydrazinylidene)methyl)2ethoxyphenolate
497228361
CCOc1cc(C=NNC(=O)Cn2c(nH+)c3c2c(=O)n(C)c(=O)n3C)ccc1(O)
MFCD02668311
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