Vitas-M small molecule compound

methyl 5-bromo-3-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}-1-benzofuran-2-carboxylate

Catalog ID
STK771134
SMILES COC(=O)c1oc2c(c1NC(=O)CCCN1C(=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 C22H17BrN2O6 MW 485.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN2O6/c1-30-22(29)19-18(15-11-12(23)8-9-16(15)31-19)24-17(26)7-4-10-25-20(27)13-5-2-3-6-14(13)21(25)28/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,24,26)
InChIKey
ZVHSHDWUCJSAFR-UHFFFAOYSA-N
Synonyms
5BROMO3((4(13DIOXO2ISOINDOLYL)1OXOBUTYL)AMINO)2BENZOFURANCARBOXYLICACIDMETHYLESTER
5BROMO3(4PHTHALIMIDOBUTANOYLAMINO)COUMARILICACIDMETHYLESTER
COC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O
METHYL3(4(13BIS(OXIDANYLIDENE)ISOINDOL2YL)BUTANOYLAMINO)5BROMANYL1BENZOFURAN2CARBOXYLATE
methyl5bromo3((4(13dioxo13dihydro2Hisoindol2yl)butanoyl)amino)1benzofuran2carboxylate
METHYL5BROMO3(4(13DIOXOISOINDOL2YL)BUTANOYLAMINO)1BENZOFURAN2CARBOXYLATE
Registry IDs
MFCD03767064
ZINC000001074201
ZINC01074201
ZINC1074201

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Available files

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