Vitas-M small molecule compound
(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl benzenesulfonate
Catalog ID
STK993050
SMILES Clc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OS(=O)(=O)c2ccccc2)c2c(c1)COCO2
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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 C23H15ClO7S MW 470.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15ClO7S/c24-16-8-14(23-15(9-16)12-28-13-29-23)10-21-22(25)19-7-6-17(11-20(19)30-21)31-32(26,27)18-4-2-1-3-5-18/h1-11H,12-13H2/b21-10-InChIKey
QPMQKFQKGSCGOT-FBHDLOMBSA-NSynonyms
929512-04-9((2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo1benzofuran6yl)benzenesulfonate
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo23dihydro1benzofuran6ylbenzenesulfonate
(Z)2((6chloro4Hbenzo(d)(13)dioxin8yl)methylene)3oxo23dihydrobenzofuran6ylbenzenesulfonate
2((6CHLORO(2H4HBENZO(E)13DIOXIN8YL))METHYLENE)3OXOBENZO(34B)FURAN6YLBENZENESULFONATE
929512049
C1C2=C(C(=CC(=C2)Cl)C=C3C(=O)C4=C(O3)C=C(C=C4)OS(=O)(=O)C5=CC=CC=C5)OCO1
Clc1cc(C=C2Oc3c(C2=O)ccc(c3)OS(=O)(=O)c2ccccc2)c2c(c1)COCO2
InChI=1SC23H15ClO7Sc2416814(2315(916)1228132923)102122(25)197617(1120(19)3021)3132(2627)184213518h111H1213H2b2110
MFCD09845906
ZINC000009531784
ZINC09531784
ZINC9531784
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