Vitas-M small molecule compound
2-({2-chloro-4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]-6-ethoxyphenoxy}methyl)benzonitrile
Catalog ID
STL367318
SMILES CCOc1cc(/C=C/c2nc(O)nc(c2[N+](=O)[O-])O)cc(c1OCc1ccccc1C#N)Cl
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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 C22H17ClN4O6 MW 468.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN4O6/c1-2-32-18-10-13(7-8-17-19(27(30)31)21(28)26-22(29)25-17)9-16(23)20(18)33-12-15-6-4-3-5-14(15)11-24/h3-10H,2,12H2,1H3,(H2,25,26,28,29)/b8-7+InChIKey
BSLGGHQKQZJUQH-BQYQJAHWSA-NSynonyms
CCOc1cc(C=Cc2nc(O)nc(c2(N+)(=O)(O))O)cc(c1OCc1ccccc1C#N)Cl
MFCD28951739
ZINC000009234772
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