Vitas-M small molecule compound

(2Z)-2-(2,6-dichlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 5-ethoxy-2-methyl-1-benzofuran-3-carboxylate

Catalog ID
STK923777
SMILES CCOc1ccc2c(c1)c(C(=O)Oc1ccc3c(c1)O/C(=C\c1c(Cl)cccc1Cl)/C3=O)c(o2)C

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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 C27H18Cl2O6 MW 509.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18Cl2O6/c1-3-32-15-8-10-22-19(11-15)25(14(2)33-22)27(31)34-16-7-9-17-23(12-16)35-24(26(17)30)13-18-20(28)5-4-6-21(18)29/h4-13H,3H2,1-2H3/b24-13-
InChIKey
YQQQYZLEYSYZMK-CFRMEGHHSA-N
Synonyms
844461-04-7
((2Z)2((26DICHLOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)5ETHOXY2METHYL1BENZOFURAN3CARBOXYLATE
(2Z)2(26dichlorobenzylidene)3oxo23dihydro1benzofuran6yl5ethoxy2methyl1benzofuran3carboxylate
(Z)2(26dichlorobenzylidene)3oxo23dihydrobenzofuran6yl5ethoxy2methylbenzofuran3carboxylate
2((26DICHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL5ETHOXY2METHYLBENZO(B)FURAN3CARBOXYLATE
844461047
CCOC1=CC2=C(C=C1)OC(=C2C(=O)OC3=CC4=C(C=C3)C(=O)C(=CC5=C(C=CC=C5Cl)Cl)O4)C
CCOc1ccc2c(c1)c(C(=O)Oc1ccc3c(c1)OC(=Cc1c(Cl)cccc1Cl)C3=O)c(o2)C
InChI=1SC27H18Cl2O6c1332158102219(1115)25(14(2)3322)27(31)3416791723(1216)3524(26(17)30)131820(28)54621(18)29h413H3H212H3b2413
MFCD04157635
ZINC000009192382
ZINC09192382
ZINC9192382

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Available files

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