Vitas-M small molecule compound

(2Z)-2-(5-bromo-2-hydroxy-3-iodobenzylidene)-1-benzothiophen-3(2H)-one

Catalog ID
STK758768
SMILES Brc1cc(/C=C/2\Sc3c(C2=O)cccc3)c(c(c1)I)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 C15H8BrIO2S MW 459.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H8BrIO2S/c16-9-5-8(14(18)11(17)7-9)6-13-15(19)10-3-1-2-4-12(10)20-13/h1-7,18H/b13-6-
InChIKey
YKDFDYFYFUHJGJ-MLPAPPSSSA-N
Synonyms

(2Z)2((5BROMO2HYDROXY3IODOPHENYL)METHYLIDENE)1BENZOTHIOPHEN3ONE
(2Z)2(5bromo2hydroxy3iodobenzylidene)1benzothiophen3(2H)one
Brc1cc(C=C2Sc3c(C2=O)cccc3)c(c(c1)I)O
C1=CC=C2C(=C1)C(=O)C(=CC3=CC(=CC(=C3O)I)Br)S2
InChI=1SC15H8BrIO2Sc16958(14(18)11(17)79)61315(19)10312412(10)2013h1718Hb136
MFCD01155055
ZINC000001061495
ZINC01061495
ZINC1061495

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Available files

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