Vitas-M small molecule compound
(2Z)-6-[(2,5-dimethylbenzyl)oxy]-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylidene]-1-benzofuran-3(2H)-one
Catalog ID
STK992799
SMILES COc1ccc2c(c1)c(/C=C/1\Oc3c(C1=O)ccc(c3)OCc1cc(C)ccc1C)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 C28H25NO4 MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25NO4/c1-17-5-6-18(2)20(11-17)16-32-22-7-9-23-26(14-22)33-27(28(23)30)12-19-15-29(3)25-10-8-21(31-4)13-24(19)25/h5-15H,16H2,1-4H3/b27-12-InChIKey
MZNFHAVAKVNQEW-PPDIBHTLSA-NSynonyms
(2Z)6((25dimethylbenzyl)oxy)2((5methoxy1methyl1Hindol3yl)methylidene)1benzofuran3(2H)one
(2Z)6((25dimethylphenyl)methoxy)2((5methoxy1methylindol3yl)methylidene)1benzofuran3one
(E)6((25dimethylbenzyl)oxy)2((5methoxy1methyl1Hindol3yl)methylene)benzofuran3(2H)one
6((25DIMETHYLPHENYL)METHOXY)2((5METHOXY1METHYLINDOL3YL)METHYLENE)BENZO(B)FURAN3ONE
CC1=CC(=C(C=C1)C)COC2=CC3=C(C=C2)C(=O)C(=CC4=CN(C5=C4C=C(C=C5)OC)C)O3
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3)OCc1cc(C)ccc1C)cn2C
InChI=1SC28H25NO4c1175618(2)20(1117)163222792326(1422)3327(28(23)30)12191529(3)2510821(314)1324(19)25h515H16H214H3b2712
MFCD18184636
ZINC000028182474
ZINC28182474
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