Vitas-M small molecule compound
(2Z)-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-methylbenzenesulfonate
Catalog ID
STK992542
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(o1)C)/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 C21H16O6S MW 396.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16O6S/c1-13-3-8-17(9-4-13)28(23,24)27-16-7-10-18-19(12-16)26-20(21(18)22)11-15-6-5-14(2)25-15/h3-12H,1-2H3/b20-11-InChIKey
FYJIIGAAFJLOKT-JAIQZWGSSA-NSynonyms
929506-00-3((2Z)2((5methylfuran2yl)methylidene)3oxo1benzofuran6yl)4methylbenzenesulfonate
(2Z)2((5methylfuran2yl)methylidene)3oxo23dihydro1benzofuran6yl4methylbenzenesulfonate
(Z)2((5methylfuran2yl)methylene)3oxo23dihydrobenzofuran6yl4methylbenzenesulfonate
2((5METHYL(2FURYL))METHYLENE)3OXOBENZO(34B)FURAN6YL4METHYLBENZENESULFONATE
929506003
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(O4)C)O3
Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)OC(=Cc1ccc(o1)C)C2=O
InChI=1SC21H16O6Sc1133817(9413)28(2324)27167101819(1216)2620(21(18)22)11156514(2)2515h312H12H3b2011
MFCD09845755
ZINC000009531100
ZINC09531100
ZINC9531100
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