Vitas-M small molecule compound
(2E)-6-[(2,5-dimethylbenzyl)oxy]-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-1-benzofuran-3(2H)-one
Catalog ID
STK653475
SMILES COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OCc1cc(C)ccc1C)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 C29H27NO4 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO4/c1-5-30-16-20(25-14-22(32-4)9-11-26(25)30)13-28-29(31)24-10-8-23(15-27(24)34-28)33-17-21-12-18(2)6-7-19(21)3/h6-16H,5,17H2,1-4H3/b28-13+InChIKey
HOQSVUFVXDNLJK-XODNFHPESA-NSynonyms
929489-96-3(2E)6((25dimethylbenzyl)oxy)2((1ethyl5methoxy1Hindol3yl)methylidene)1benzofuran3(2H)one
(2E)6((25dimethylphenyl)methoxy)2((1ethyl5methoxyindol3yl)methylidene)1benzofuran3one
(E)6((25dimethylbenzyl)oxy)2((1ethyl5methoxy1Hindol3yl)methylene)benzofuran3(2H)one
929489963
CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C=C(C=C4)OCC5=C(C=CC(=C5)C)C
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3)OCc1cc(C)ccc1C)cn2CC
InChI=1SC29H27NO4c15301620(251422(324)91126(25)30)132829(31)2410823(1527(24)3428)3317211218(2)6719(21)3h616H517H214H3b2813+
MFCD09844775
ZINC000009422152
ZINC09422152
ZINC9422152
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