Vitas-M small molecule compound
(2Z)-2-(4-chlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl benzenesulfonate
Catalog ID
STK992296
SMILES Clc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccccc1
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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 C21H13ClO5S MW 412.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClO5S/c22-15-8-6-14(7-9-15)12-20-21(23)18-11-10-16(13-19(18)26-20)27-28(24,25)17-4-2-1-3-5-17/h1-13H/b20-12-InChIKey
IHKGMYXQZAYULQ-NDENLUEZSA-NSynonyms
929390-93-2((2Z)2((4chlorophenyl)methylidene)3oxo1benzofuran6yl)benzenesulfonate
(2Z)2(4chlorobenzylidene)3oxo23dihydro1benzofuran6ylbenzenesulfonate
(Z)2(4chlorobenzylidene)3oxo23dihydrobenzofuran6ylbenzenesulfonate
2((4CHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLBENZENESULFONATE
929390932
C1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(C=C4)Cl)O3
Clc1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccccc1
InChI=1SC21H13ClO5Sc22158614(7915)122021(23)18111016(1319(18)2620)2728(2425)174213517h113Hb2012
MFCD08750557
ZINC000009419597
ZINC09419597
ZINC9419597
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