Vitas-M small molecule compound
5-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-6-hydroxy-1-(2-methoxyphenyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Catalog ID
STL525229
SMILES COc1c(OC)ccc2c1C(=O)OC2c1c(=O)[nH]c(=S)n(c1O)c1ccccc1OC
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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 C21H18N2O7S MW 442.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O7S/c1-27-12-7-5-4-6-11(12)23-19(25)15(18(24)22-21(23)31)16-10-8-9-13(28-2)17(29-3)14(10)20(26)30-16/h4-9,16,25H,1-3H3,(H,22,24,31)InChIKey
UJSCLCJAACODOQ-UHFFFAOYSA-NSynonyms
374708-77-7374708777
3839154
5(45dimethoxy3oxo1~(H)2benzofuran1yl)6hydroxy1(2methoxyphenyl)2sulfanylidenepyrimidin4one
5(45dimethoxy3oxo13dihydro2benzofuran1yl)6hydroxy1(2methoxyphenyl)2thioxo23dihydropyrimidin4(1H)one
5(45DIMETHOXY3OXO13DIHYDROISOBENZOFURAN1YL)6HYDROXY1(2METHOXYPHENYL)2THIOXO23DIHYDROPYRIMIDIN4(1H)ONE
5(45DIMETHOXY3OXO1H2BENZOFURAN1YL)6HYDROXY1(2METHOXYPHENYL)2SULFANYLIDENEPYRIMIDIN4ONE
COc1c(OC)ccc2c1C(=O)OC2c1c(=O)(nH)c(=S)n(c1O)c1ccccc1OC
InChI=1SC21H18N2O7Sc12712754611(12)2319(25)15(18(24)2221(23)31)16108913(282)17(293)14(10)20(26)3016h491625H13H3(H222431)
MFCD02056702
ZINC000002144842
ZINC000012658128
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