Vitas-M small molecule compound

(2E)-2-[(1-ethyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,4-dimethoxybenzoate

Catalog ID
STK629357
SMILES COc1cc(ccc1OC)C(=O)Oc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)CC)/C2=O

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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 C28H23NO6 MW 469.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23NO6/c1-4-29-16-18(20-7-5-6-8-22(20)29)14-26-27(30)21-11-10-19(15-24(21)35-26)34-28(31)17-9-12-23(32-2)25(13-17)33-3/h5-16H,4H2,1-3H3/b26-14+
InChIKey
VNRZPSUXLZANDG-VULFUBBASA-N
Synonyms
929418-21-3
((2E)2((1ethylindol3yl)methylidene)3oxo1benzofuran6yl)34dimethoxybenzoate
(2E)2((1ethyl1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6yl34dimethoxybenzoate
(E)2((1ethyl1Hindol3yl)methylene)3oxo23dihydrobenzofuran6yl34dimethoxybenzoate
2((1ETHYLINDOL3YL)METHYLENE)3OXOBENZO(34B)FURAN6YL34DIMETHOXYBENZOATE
929418213
CCN1C=C(C2=CC=CC=C21)C=C3C(=O)C4=C(O3)C=C(C=C4)OC(=O)C5=CC(=C(C=C5)OC)OC
COc1cc(ccc1OC)C(=O)Oc1ccc2c(c1)OC(=Cc1cn(c3c1cccc3)CC)C2=O
InChI=1SC28H23NO6c14291618(20756822(20)29)142627(30)21111019(1524(21)3526)3428(31)1791223(322)25(1317)333h516H4H213H3b2614+
MFCD09796024
ZINC000008993342
ZINC08993342
ZINC8993342

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Available files

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