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-[4-(trifluoromethoxy)phenyl]hex-4-enamide
Catalog ID
STL471016
SMILES COc1c(C/C=C(/CCC(=O)Nc2ccc(cc2)OC(F)(F)F)\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 C24H24F3NO6 MW 479.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24F3NO6/c1-13(5-11-19(29)28-15-6-8-16(9-7-15)34-24(25,26)27)4-10-17-21(30)20-18(12-33-23(20)31)14(2)22(17)32-3/h4,6-9,30H,5,10-12H2,1-3H3,(H,28,29)/b13-4+InChIKey
DMLAGDCXJAOFCX-YIXHJXPBSA-NSynonyms
1282459-01-1(4E)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)4methylN(4(trifluoromethoxy)phenyl)hex4enamide
(E)6(4hydroxy6methoxy7methyl3oxo13dihydroisobenzofuran5yl)4methylN(4(trifluoromethoxy)phenyl)hex4enamide
(E)6(4hydroxy6methoxy7methyl3oxo1H2benzofuran5yl)4methylN(4(trifluoromethoxy)phenyl)hex4enamide
1282459011
CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)NC3=CC=C(C=C3)OC(F)(F)F)OC
COc1c(CC=C(CCC(=O)Nc2ccc(cc2)OC(F)(F)F)C)c(O)c2c(c1C)COC2=O
InChI=1SC24H24F3NO6c113(51119(29)28156816(9715)3424(2526)27)4101721(30)2018(123323(20)31)14(2)22(17)323h46930H51012H213H3(H2829)b134+
MFCD18790981
ZINC000062001576
ZINC62001576
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