Vitas-M small molecule compound

(5E)-3-(3-fluorophenyl)-6-hydroxy-5-{4-[(5-nitropyridin-2-yl)oxy]benzylidene}pyrimidine-2,4(3H,5H)-dione

Catalog ID
STK856445
SMILES Fc1cccc(c1)N1C(=O)N=C(/C(=C\c2ccc(cc2)Oc2ccc(cn2)[N+](=O)[O-])/C1=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 C22H13FN4O6 MW 448.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13FN4O6/c23-14-2-1-3-15(11-14)26-21(29)18(20(28)25-22(26)30)10-13-4-7-17(8-5-13)33-19-9-6-16(12-24-19)27(31)32/h1-12H,(H,25,28,30)/b18-10+
InChIKey
DWOZRMBMNDHQPO-VCHYOVAHSA-N
Synonyms

Fc1cccc(c1)N1C(=O)N=C(C(=Cc2ccc(cc2)Oc2ccc(cn2)(N+)(=O)(O))C1=O)O
MFCD09788996
ZINC000013548932

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.