Vitas-M small molecule compound

3-{[(2E,5Z)-5-(3-bromo-4-methoxybenzylidene)-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoic acid

Catalog ID
STK743055
SMILES CCN1/C(=N\c2cccc(c2)C(=O)O)/S/C(=C\c2ccc(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 C20H17BrN2O4S MW 461.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrN2O4S/c1-3-23-18(24)17(10-12-7-8-16(27-2)15(21)9-12)28-20(23)22-14-6-4-5-13(11-14)19(25)26/h4-11H,3H2,1-2H3,(H,25,26)/b17-10-,22-20+
InChIKey
AXYSZBJGWPJPLR-LVVZJAEZSA-N
Synonyms
675168-72-6
3(((2E5Z)5(3bromo4methoxybenzylidene)3ethyl4oxo13thiazolidin2ylidene)amino)benzoicacid
3((E)((Z)5(3bromo4methoxybenzylidene)3ethyl4oxothiazolidin2ylidene)amino)benzoicacid
675168726
CCN1C(=Nc2cccc(c2)C(=O)O)SC(=Cc2ccc(c(c2)Br)OC)C1=O
MFCD03675164
ZINC000100309209

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Available files

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