Vitas-M small molecule compound

methyl [(4E)-4-(3-fluorobenzylidene)-2,5-dioxoimidazolidin-1-yl]acetate

Catalog ID
STK216443
SMILES COC(=O)CN1C(=O)N/C(=C/c2cccc(c2)F)/C1=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 C13H11FN2O4 MW 278.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11FN2O4/c1-20-11(17)7-16-12(18)10(15-13(16)19)6-8-3-2-4-9(14)5-8/h2-6H,7H2,1H3,(H,15,19)/b10-6+
InChIKey
YVKWSTVQZHHGTK-UXBLZVDNSA-N
Synonyms

COC(=O)CN1C(=O)C(=CC2=CC(=CC=C2)F)NC1=O
COC(=O)CN1C(=O)NC(=Cc2cccc(c2)F)C1=O
InChI=1SC13H11FN2O4c12011(17)71612(18)10(1513(16)19)683249(14)58h26H7H21H3(H1519)b106+
methyl((4E)4(3fluorobenzylidene)25dioxoimidazolidin1yl)acetate
METHYL2((4E)4((3FLUOROPHENYL)METHYLIDENE)25DIOXOIMIDAZOLIDIN1YL)ACETATE
MFCD07393638
ZINC000004813715
ZINC04813715
ZINC4813715

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Available files

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