Vitas-M small molecule compound

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

Catalog ID
STK727457
SMILES COc1cc(/C=C/2\S/C(=N/c3cccc(c3)C(=O)O)/N(C2=O)C)cc(c1O)Cl

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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 C19H15ClN2O5S MW 418.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClN2O5S/c1-22-17(24)15(8-10-6-13(20)16(23)14(7-10)27-2)28-19(22)21-12-5-3-4-11(9-12)18(25)26/h3-9,23H,1-2H3,(H,25,26)/b15-8-,21-19+
InChIKey
SGPBBDUPVGAAGI-KICHGUGOSA-N
Synonyms
443876-79-7
3(((2E5Z)5(3chloro4hydroxy5methoxybenzylidene)3methyl4oxo13thiazolidin2ylidene)amino)benzoicacid
3((E)((Z)5(3chloro4hydroxy5methoxybenzylidene)3methyl4oxothiazolidin2ylidene)amino)benzoicacid
443876797
COc1cc(C=C2SC(=Nc3cccc(c3)C(=O)O)N(C2=O)C)cc(c1O)Cl
MFCD03031863
ZINC000002230838

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Available files

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