Vitas-M small molecule compound

methyl 3-({(E)-[3-(4-fluorophenyl)-6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl]methylidene}amino)benzoate

Catalog ID
STK137142
SMILES COC(=O)c1cccc(c1)/N=C/c1c(O)[nH]c(=O)n(c1=O)c1ccc(cc1)F

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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 C19H14FN3O5 MW 383.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14FN3O5/c1-28-18(26)11-3-2-4-13(9-11)21-10-15-16(24)22-19(27)23(17(15)25)14-7-5-12(20)6-8-14/h2-10,24H,1H3,(H,22,27)/b21-10+
InChIKey
XIPMPOCUPHZZLP-UFFVCSGVSA-N
Synonyms

COC(=O)c1cccc(c1)N=Cc1c(O)(nH)c(=O)n(c1=O)c1ccc(cc1)F
methyl3(((E)(3(4fluorophenyl)6hydroxy24dioxo1234tetrahydropyrimidin5yl)methylidene)amino)benzoate
MFCD08679215
ZINC000101597148

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Available files

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