Vitas-M small molecule compound
(2Z)-2-(2,6-dichlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-methoxybenzenesulfonate
Catalog ID
STK992782
SMILES COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1c(Cl)cccc1Cl)/C2=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 C22H14Cl2O6S MW 477.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14Cl2O6S/c1-28-13-5-8-15(9-6-13)31(26,27)30-14-7-10-16-20(11-14)29-21(22(16)25)12-17-18(23)3-2-4-19(17)24/h2-12H,1H3/b21-12-InChIKey
CODIKRMACMYRGC-MTJSOVHGSA-NSynonyms
929489-19-0((2Z)2((26dichlorophenyl)methylidene)3oxo1benzofuran6yl)4methoxybenzenesulfonate
(2Z)2(26dichlorobenzylidene)3oxo23dihydro1benzofuran6yl4methoxybenzenesulfonate
(Z)2(26dichlorobenzylidene)3oxo23dihydrobenzofuran6yl4methoxybenzenesulfonate
2((26DICHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL4METHOXYBENZENESULFONATE
929489190
COC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=C(C=CC=C4Cl)Cl)O3
COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)OC(=Cc1c(Cl)cccc1Cl)C2=O
InChI=1SC22H14Cl2O6Sc128135815(9613)31(2627)30147101620(1114)2921(22(16)25)121718(23)32419(17)24h212H1H3b2112
MFCD09846500
ZINC000009575844
ZINC09575844
ZINC9575844
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