Vitas-M small molecule compound

(4E)-4-{4-[2-(3-methoxyphenoxy)ethoxy]benzylidene}-1-phenylpyrazolidine-3,5-dione

Catalog ID
STK073653
SMILES COc1cccc(c1)OCCOc1ccc(cc1)/C=C/1\C(=O)NN(C1=O)c1ccccc1

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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 C25H22N2O5 MW 430.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O5/c1-30-21-8-5-9-22(17-21)32-15-14-31-20-12-10-18(11-13-20)16-23-24(28)26-27(25(23)29)19-6-3-2-4-7-19/h2-13,16-17H,14-15H2,1H3,(H,26,28)/b23-16+
InChIKey
HJPLVLMFYXESTH-XQNSMLJCSA-N
Synonyms

(4E)4((4(2(3METHOXYPHENOXY)ETHOXY)PHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(4(2(3METHOXYPHENOXY)ETHOXY)BENZYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(Z)4(4(2(3methoxyphenoxy)ethoxy)benzylidene)1phenylpyrazolidine35dione
COC1=CC(=CC=C1)OCCOC2=CC=C(C=C2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4
COc1cccc(c1)OCCOc1ccc(cc1)C=C1C(=O)NN(C1=O)c1ccccc1
InChI=1SC25H22N2O5c1302185922(1721)3215143120121018(111320)162324(28)2627(25(23)29)196324719h2131617H1415H21H3(H2628)b2316+
MFCD02120809
STK073653
ZINC000001830874
ZINC01830874
ZINC1830874

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Available files

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