Vitas-M small molecule compound
(5E)-5-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-methoxybenzylidene}-3-(4-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STL379380
SMILES COc1cc(/C=C\2/SC(=O)N(C2=O)Cc2ccc(cc2)[N+](=O)[O-])cc(c1OCc1ccccc1Cl)Br
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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 C25H18BrClN2O6S MW 589.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18BrClN2O6S/c1-34-21-11-16(10-19(26)23(21)35-14-17-4-2-3-5-20(17)27)12-22-24(30)28(25(31)36-22)13-15-6-8-18(9-7-15)29(32)33/h2-12H,13-14H2,1H3/b22-12+InChIKey
MZVYJKRWLWSDMH-WSDLNYQXSA-NSynonyms
(5E)5((3bromo4((2chlorophenyl)methoxy)5methoxyphenyl)methylidene)3((4nitrophenyl)methyl)13thiazolidine24dione
(5E)5(3bromo4((2chlorobenzyl)oxy)5methoxybenzylidene)3(4nitrobenzyl)13thiazolidine24dione
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)(N+)(=O)(O))Br)OCC4=CC=CC=C4Cl
COc1cc(C=C2SC(=O)N(C2=O)Cc2ccc(cc2)(N+)(=O)(O))cc(c1OCc1ccccc1Cl)Br
InChI=1SC25H18BrClN2O6Sc134211116(1019(26)23(21)351417423520(17)27)122224(30)28(25(31)3622)13156818(9715)29(32)33h212H1314H21H3b2212+
MFCD04085472
ZINC000100360601
ZINC100360601
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