Vitas-M small molecule compound

(5E)-5-(2-bromo-4-hydroxy-5-methoxybenzylidene)-3-(4-methoxybenzyl)-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STL419131
SMILES COc1ccc(cc1)CN1C(=S)S/C(=C/c2cc(OC)c(cc2Br)O)/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 C19H16BrNO4S2 MW 466.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrNO4S2/c1-24-13-5-3-11(4-6-13)10-21-18(23)17(27-19(21)26)8-12-7-16(25-2)15(22)9-14(12)20/h3-9,22H,10H2,1-2H3/b17-8+
InChIKey
IMBJPPUVCVODPU-CAOOACKPSA-N
Synonyms

(5E)5((2bromo4hydroxy5methoxyphenyl)methylidene)3((4methoxyphenyl)methyl)2sulfanylidene13thiazolidin4one
(5E)5(2bromo4hydroxy5methoxybenzylidene)3(4methoxybenzyl)2thioxo13thiazolidin4one
COC1=CC=C(C=C1)CN2C(=O)C(=CC3=CC(=C(C=C3Br)O)OC)SC2=S
COc1ccc(cc1)CN1C(=S)SC(=Cc2cc(OC)c(cc2Br)O)C1=O
InChI=1SC19H16BrNO4S2c124135311(4613)102118(23)17(2719(21)26)812716(252)15(22)914(12)20h3922H10H212H3b178+
MFCD05041205
ZINC000015012129
ZINC15012129

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Available files

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