Vitas-M small molecule compound

ethyl 5-bromo-3-[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propyl]-1H-indole-2-carboxylate

Catalog ID
STK365334
SMILES CCOC(=O)c1[nH]c2c(c1CCCN1C(=O)c3c(C1=O)cccc3)cc(cc2)Br

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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 C22H19BrN2O4 MW 455.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrN2O4/c1-2-29-22(28)19-14(17-12-13(23)9-10-18(17)24-19)8-5-11-25-20(26)15-6-3-4-7-16(15)21(25)27/h3-4,6-7,9-10,12,24H,2,5,8,11H2,1H3
InChIKey
STKJPMXASUTCHS-UHFFFAOYSA-N
Synonyms
282103-27-9
282103279
CCOC(=O)c1(nH)c2c(c1CCCN1C(=O)c3c(C1=O)cccc3)cc(cc2)Br
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)CCCN3C(=O)C4=CC=CC=C4C3=O
ETHYL3(3(13DIOXOBENZO(C)AZOLIDIN2YL)PROPYL)5BROMOINDOLE2CARBOXYLATE
ethyl5bromo3(3(13dioxo13dihydro2Hisoindol2yl)propyl)1Hindole2carboxylate
ETHYL5BROMO3(3(13DIOXOISOINDOL2YL)PROPYL)1HINDOLE2CARBOXYLATE
ethyl5bromo3(3(13dioxoisoindolin2yl)propyl)1Hindole2carboxylate
InChI=1SC22H19BrN2O4c122922(28)1914(171213(23)91018(17)2419)85112520(26)15634716(15)21(25)27h34679101224H25811H21H3
MFCD00344436
ZINC000002202783
ZINC02202783
ZINC2202783

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Available files

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