Vitas-M small molecule compound

(4Z)-4-{3-chloro-4-[(2,6-dichlorobenzyl)oxy]-5-ethoxybenzylidene}-1-phenylpyrazolidine-3,5-dione

Catalog ID
STK079067
SMILES CCOc1cc(/C=C\2/C(=O)NN(C2=O)c2ccccc2)cc(c1OCc1c(Cl)cccc1Cl)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 C25H19Cl3N2O4 MW 517.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19Cl3N2O4/c1-2-33-22-13-15(11-17-24(31)29-30(25(17)32)16-7-4-3-5-8-16)12-21(28)23(22)34-14-18-19(26)9-6-10-20(18)27/h3-13H,2,14H2,1H3,(H,29,31)/b17-11-
InChIKey
RERDDHCUIJCRKX-BOPFTXTBSA-N
Synonyms

(4Z)4((3CHLORO4((26DICHLOROPHENYL)METHOXY)5ETHOXYPHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4Z)4(3CHLORO4((26DICHLOROBENZYL)OXY)5ETHOXYBENZYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Cl)OCC4=C(C=CC=C4Cl)Cl
CCOc1cc(C=C2C(=O)NN(C2=O)c2ccccc2)cc(c1OCc1c(Cl)cccc1Cl)Cl
InChI=1SC25H19Cl3N2O4c1233221315(111724(31)2930(25(17)32)167435816)1221(28)23(22)34141819(26)961020(18)27h313H214H21H3(H2931)b1711
MFCD03184291
STK079067
ZINC000013892746
ZINC13892746

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Available files

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