Vitas-M small molecule compound

(5E)-5-{3-bromo-4-[(4-fluorobenzyl)oxy]-5-methoxybenzylidene}-3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1,3-thiazolidine-2,4-dione

Catalog ID
STL376543
SMILES COc1cc(/C=C\2/SC(=O)N(C2=O)Cc2cc3OCOc3cc2Cl)cc(c1OCc1ccc(cc1)F)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 C26H18BrClFNO6S MW 606.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18BrClFNO6S/c1-33-22-7-15(6-18(27)24(22)34-12-14-2-4-17(29)5-3-14)8-23-25(31)30(26(32)37-23)11-16-9-20-21(10-19(16)28)36-13-35-20/h2-10H,11-13H2,1H3/b23-8+
InChIKey
FGWCODXKBDDDPL-LIMNOBDPSA-N
Synonyms

(5E)5((3bromo4((4fluorophenyl)methoxy)5methoxyphenyl)methylidene)3((6chloro13benzodioxol5yl)methyl)13thiazolidine24dione
(5E)5(3bromo4((4fluorobenzyl)oxy)5methoxybenzylidene)3((6chloro13benzodioxol5yl)methyl)13thiazolidine24dione
5(3BROMO4((4FLUOROBENZYL)OXY)5METHOXYBENZYLIDENE)3((6CHLORO13BENZODIOXOL5YL)METHYL)13THIAZOLIDINE24DIONE
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC4=C(C=C3Cl)OCO4)Br)OCC5=CC=C(C=C5)F
COc1cc(C=C2SC(=O)N(C2=O)Cc2cc3OCOc3cc2Cl)cc(c1OCc1ccc(cc1)F)Br
InChI=1SC26H18BrClFNO6Sc13322715(618(27)24(22)3412142417(29)5314)82325(31)30(26(32)3723)111692021(1019(16)28)36133520h210H1113H21H3b238+
MFCD03865289
ZINC000008439278
ZINC08439278
ZINC8439278

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Available files

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