Vitas-M small molecule compound

(2Z)-2-[(1-ethyl-1H-indol-3-yl)methylidene]-6-[(2-methylbenzyl)oxy]-1-benzofuran-3(2H)-one

Catalog ID
STK992856
SMILES CCn1cc(c2c1cccc2)/C=C/1\Oc2c(C1=O)ccc(c2)OCc1ccccc1C

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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 C27H23NO3 MW 409.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO3/c1-3-28-16-20(22-10-6-7-11-24(22)28)14-26-27(29)23-13-12-21(15-25(23)31-26)30-17-19-9-5-4-8-18(19)2/h4-16H,3,17H2,1-2H3/b26-14-
InChIKey
KBYMHNJAXCWWFR-WGARJPEWSA-N
Synonyms

(2Z)2((1ethyl1Hindol3yl)methylidene)6((2methylbenzyl)oxy)1benzofuran3(2H)one
(2Z)2((1ethylindol3yl)methylidene)6((2methylphenyl)methoxy)1benzofuran3one
(E)2((1ethyl1Hindol3yl)methylene)6((2methylbenzyl)oxy)benzofuran3(2H)one
2((1ETHYLINDOL3YL)METHYLENE)6((2METHYLPHENYL)METHOXY)BENZO(B)FURAN3ONE
CCN1C=C(C2=CC=CC=C21)C=C3C(=O)C4=C(O3)C=C(C=C4)OCC5=CC=CC=C5C
CCn1cc(c2c1cccc2)C=C1Oc2c(C1=O)ccc(c2)OCc1ccccc1C
InChI=1SC27H23NO3c13281620(2210671124(22)28)142627(29)23131221(1525(23)3126)301719954818(19)2h416H317H212H3b2614
MFCD18184671
ZINC000028182537
ZINC28182537

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.