Vitas-M small molecule compound

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

Catalog ID
STL374245
SMILES COc1ccc(cc1OC)/C=C/1\S/C(=N/c2ccc(cc2)C(=O)O)/N(C1=O)C

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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 C20H18N2O5S MW 398.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5S/c1-22-18(23)17(11-12-4-9-15(26-2)16(10-12)27-3)28-20(22)21-14-7-5-13(6-8-14)19(24)25/h4-11H,1-3H3,(H,24,25)/b17-11-,21-20+
InChIKey
BAUGTWJHVJOLSL-YBLIXAOFSA-N
Synonyms

4(((2E5Z)5(34dimethoxybenzylidene)3methyl4oxo13thiazolidin2ylidene)amino)benzoicacid
COc1ccc(cc1OC)C=C1SC(=Nc2ccc(cc2)C(=O)O)N(C1=O)C
MFCD03031913
ZINC000097456580

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Available files

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