Vitas-M small molecule compound
(2Z)-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-methoxybenzenesulfonate
Catalog ID
STK856164
SMILES COc1ccc(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 C21H16O7S MW 412.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16O7S/c1-13-3-4-15(26-13)11-20-21(22)18-10-7-16(12-19(18)27-20)28-29(23,24)17-8-5-14(25-2)6-9-17/h3-12H,1-2H3/b20-11-InChIKey
PCDPCYHAQBTTHK-JAIQZWGSSA-NSynonyms
929372-70-3((2Z)2((5methylfuran2yl)methylidene)3oxo1benzofuran6yl)4methoxybenzenesulfonate
(2Z)2((5methylfuran2yl)methylidene)3oxo23dihydro1benzofuran6yl4methoxybenzenesulfonate
(Z)2((5methylfuran2yl)methylene)3oxo23dihydrobenzofuran6yl4methoxybenzenesulfonate
2((5METHYL(2FURYL))METHYLENE)3OXOBENZO(34B)FURAN6YL4METHOXYBENZENESULFONATE
929372703
CC1=CC=C(O1)C=C2C(=O)C3=C(O2)C=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)OC(=Cc1ccc(o1)C)C2=O
InChI=1SC21H16O7Sc1133415(2613)112021(22)1810716(1219(18)2720)2829(2324)178514(252)6917h312H12H3b2011
MFCD09789232
ZINC000009477150
ZINC09477150
ZINC9477150
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