Vitas-M small molecule compound

5-bromo-2-({[2-(2-ethoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)benzoic acid

Catalog ID
STK011686
SMILES CCOc1ccccc1N1C(=O)c2c(C1=O)ccc(c2)C(=O)Nc1ccc(cc1C(=O)O)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 C24H17BrN2O6 MW 509.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17BrN2O6/c1-2-33-20-6-4-3-5-19(20)27-22(29)15-9-7-13(11-16(15)23(27)30)21(28)26-18-10-8-14(25)12-17(18)24(31)32/h3-12H,2H2,1H3,(H,26,28)(H,31,32)
InChIKey
WFFUOXFMQPOREX-UHFFFAOYSA-N
Synonyms

5BROMO2(((2(2ETHOXYPHENYL)13DIOXO23DIHYDRO1HISOINDOL5YL)CARBONYL)AMINO)BENZOICACID
5BROMO2((2(2ETHOXYPHENYL)13DIOXOISOINDOLE5CARBONYL)AMINO)BENZOICACID
CCOC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=C(C=C(C=C4)Br)C(=O)O
CCOc1ccccc1N1C(=O)c2c(C1=O)ccc(c2)C(=O)Nc1ccc(cc1C(=O)O)Br
InChI=1SC24H17BrN2O6c123320643519(20)2722(29)159713(1116(15)23(27)30)21(28)261810814(25)1217(18)24(31)32h312H2H21H3(H2628)(H3132)
MFCD02189637
STK011686
ZINC000008417527
ZINC8417527

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Available files

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