Vitas-M small molecule compound

(5E)-5-(3,5-dibromo-4-methoxybenzylidene)-3-ethyl-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK742260
SMILES CCN1C(=S)S/C(=C/c2cc(Br)c(c(c2)Br)OC)/C1=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 C13H11Br2NO2S2 MW 437.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11Br2NO2S2/c1-3-16-12(17)10(20-13(16)19)6-7-4-8(14)11(18-2)9(15)5-7/h4-6H,3H2,1-2H3/b10-6+
InChIKey
FBJBHCOQZQLEDN-UXBLZVDNSA-N
Synonyms

(5E)5((35DIBROMO4METHOXYPHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(35dibromo4methoxybenzylidene)3ethyl2thioxo13thiazolidin4one
CCN1C(=O)C(=CC2=CC(=C(C(=C2)Br)OC)Br)SC1=S
CCN1C(=S)SC(=Cc2cc(Br)c(c(c2)Br)OC)C1=O
InChI=1SC13H11Br2NO2S2c131612(17)10(2013(16)19)6748(14)11(182)9(15)57h46H3H212H3b106+
MFCD02108931
ZINC000009296526
ZINC09296526
ZINC9296526

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Available files

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