Vitas-M small molecule compound
(2Z)-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-6-hydroxy-7-(piperidin-1-ylmethyl)-1-benzofuran-3(2H)-one
Catalog ID
STL034994
SMILES COc1ccc2c(c1)c(/C=C/1\Oc3c(C1=O)ccc(c3CN1CCCCC1)O)cn2CC
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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 C26H28N2O4 MW 432.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O4/c1-3-28-15-17(20-14-18(31-2)7-9-22(20)28)13-24-25(30)19-8-10-23(29)21(26(19)32-24)16-27-11-5-4-6-12-27/h7-10,13-15,29H,3-6,11-12,16H2,1-2H3/b24-13-InChIKey
SOPICGUTXPCZFE-CFRMEGHHSA-NSynonyms
(2Z)2((1ethyl5methoxy1Hindol3yl)methylidene)6hydroxy7(piperidin1ylmethyl)1benzofuran3(2H)one
(2Z)2((1ethyl5methoxyindol3yl)methylidene)3oxo7(piperidin1ium1ylmethyl)1benzofuran6olate
(E)2((1ethyl5methoxy1Hindol3yl)methylene)6hydroxy7(piperidin1ylmethyl)benzofuran3(2H)one
2((1ETHYL5METHOXYINDOL3YL)METHYLENE)6HYDROXY7(PIPERIDYLMETHYL)BENZO(B)FURAN3ONE
CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C(=C(C=C4)(O))C(NH+)5CCCCC5
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3CN1CCCCC1)O)cn2CC
InChI=1SC26H28N2O4c13281517(201418(312)7922(20)28)132425(30)1981023(29)21(26(19)3224)1627115461227h710131529H36111216H212H3b2413
MFCD18191951
ZINC000028182802
ZINC28182802
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