Vitas-M small molecule compound
(2Z)-2-(3-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-chlorobenzenesulfonate
Catalog ID
STK992406
SMILES COc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)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 C22H15ClO6S MW 442.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClO6S/c1-27-16-4-2-3-14(11-16)12-21-22(24)19-10-7-17(13-20(19)28-21)29-30(25,26)18-8-5-15(23)6-9-18/h2-13H,1H3/b21-12-InChIKey
XBNQYXJVMREOFK-MTJSOVHGSA-NSynonyms
929505-49-7((2Z)2((3methoxyphenyl)methylidene)3oxo1benzofuran6yl)4chlorobenzenesulfonate
(2Z)2(3methoxybenzylidene)3oxo23dihydro1benzofuran6yl4chlorobenzenesulfonate
(Z)2(3methoxybenzylidene)3oxo23dihydrobenzofuran6yl4chlorobenzenesulfonate
2((3METHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL4CHLOROBENZENESULFONATE
929505497
COC1=CC=CC(=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)Cl
COc1cccc(c1)C=C1Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)Cl
InChI=1SC22H15ClO6Sc1271642314(1116)122122(24)1910717(1320(19)2821)2930(2526)188515(23)6918h213H1H3b2112
MFCD09845201
ZINC000009485986
ZINC09485986
ZINC9485986
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