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-(quinolin-5-yl)hex-4-enamide
Catalog ID
STL521665
SMILES COc1c(C/C=C(/CCC(=O)Nc2cccc3c2cccn3)\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 C26H26N2O5 MW 446.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O5/c1-15(10-12-22(29)28-21-8-4-7-20-17(21)6-5-13-27-20)9-11-18-24(30)23-19(14-33-26(23)31)16(2)25(18)32-3/h4-9,13,30H,10-12,14H2,1-3H3,(H,28,29)/b15-9+InChIKey
AOMIMZNZMYVLHR-OQLLNIDSSA-NSynonyms
1574537-09-9(~(E))6(4hydroxy6methoxy7methyl3oxo1~(H)2benzofuran5yl)4methyl~(N)quinolin5ylhex4enamide
(4E)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)4methylN(quinolin5yl)hex4enamide
(E)6(4HYDROXY6METHOXY7METHYL3OXO13DIHYDROISOBENZOFURAN5YL)4METHYLN(QUINOLIN5YL)HEX4ENAMIDE
1574537099
75464683
COc1c(CC=C(CCC(=O)Nc2cccc3c2cccn3)C)c(O)c2c(c1C)COC2=O
InChI=1SC26H26N2O5c115(101222(29)28218472017(21)65132720)9111824(30)2319(143326(23)31)16(2)25(18)323h491330H101214H213H3(H2829)b159+
MFCD28051404
ZINC000096115234
ZINC96115234
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