Vitas-M small molecule compound
(4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]hex-4-enamide
Catalog ID
STL520424
SMILES COc1c(C/C=C(/CCC(=O)/N=c\2/[nH]nc(s2)C)\C)c(O)c2c(c1C)COC2=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 C20H23N3O5S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O5S/c1-10(6-8-15(24)21-20-23-22-12(3)29-20)5-7-13-17(25)16-14(9-28-19(16)26)11(2)18(13)27-4/h5,25H,6-9H2,1-4H3,(H,21,23,24)/b10-5+InChIKey
VRHTXFWRJFHNEW-BJMVGYQFSA-NSynonyms
1282459-19-1(~(E))6(4hydroxy6methoxy7methyl3oxo1~(H)2benzofuran5yl)4methyl~(N)(5methyl134thiadiazol2yl)hex4enamide
(4E)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)4methylN((2Z)5methyl134thiadiazol2(3H)ylidene)hex4enamide
(E)6(4HYDROXY6METHOXY7METHYL3OXO13DIHYDROISOBENZOFURAN5YL)4METHYLN(5METHYL134THIADIAZOL2YL)HEX4ENAMIDE
1282459191
52905267
MFCD31752232
ZINC000062001520
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