Vitas-M small molecule compound
(2Z)-6-hydroxy-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylidene]-7-(piperidin-1-ylmethyl)-1-benzofuran-3(2H)-one
Catalog ID
STK992746
SMILES COc1ccc2c(c1)c(/C=C/1\Oc3c(C1=O)ccc(c3CN1CCCCC1)O)cn2C
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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 C25H26N2O4 MW 418.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O4/c1-26-14-16(19-13-17(30-2)6-8-21(19)26)12-23-24(29)18-7-9-22(28)20(25(18)31-23)15-27-10-4-3-5-11-27/h6-9,12-14,28H,3-5,10-11,15H2,1-2H3/b23-12-InChIKey
LFPBFMIGOXINTN-FMCGGJTJSA-NSynonyms
(2Z)2((5methoxy1methylindol3yl)methylidene)3oxo7(piperidin1ium1ylmethyl)1benzofuran6olate
(2Z)6hydroxy2((5methoxy1methyl1Hindol3yl)methylidene)7(piperidin1ylmethyl)1benzofuran3(2H)one
(E)6hydroxy2((5methoxy1methyl1Hindol3yl)methylene)7(piperidin1ylmethyl)benzofuran3(2H)one
6HYDROXY2((5METHOXY1METHYLINDOL3YL)METHYLENE)7(PIPERIDYLMETHYL)BENZO(B)FURAN3ONE
CN1C=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)cn2C
InChI=1SC25H26N2O4c1261416(191317(302)6821(19)26)122324(29)187922(28)20(25(18)3123)1527104351127h69121428H35101115H212H3b2312
MFCD18184621
ZINC000028182444
ZINC28182444
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