Vitas-M small molecule compound
(5Z)-5-{2-bromo-4-[(2-chlorobenzyl)oxy]-5-methoxybenzylidene}-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL375157
SMILES COc1cc(/C=C/2\SC(=S)N(C2=O)CC2CCCO2)c(cc1OCc1ccccc1Cl)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 C23H21BrClNO4S2 MW 554.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrClNO4S2/c1-28-19-9-15(17(24)11-20(19)30-13-14-5-2-3-7-18(14)25)10-21-22(27)26(23(31)32-21)12-16-6-4-8-29-16/h2-3,5,7,9-11,16H,4,6,8,12-13H2,1H3/b21-10-InChIKey
QUPBXDGBYHJSHK-FBHDLOMBSA-NSynonyms
(5Z)5((2BROMO4((2CHLOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENE)3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(2bromo4((2chlorobenzyl)oxy)5methoxybenzylidene)3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin4one
COC1=C(C=C(C(=C1)C=C2C(=O)N(C(=S)S2)CC3CCCO3)Br)OCC4=CC=CC=C4Cl
COc1cc(C=C2SC(=S)N(C2=O)CC2CCCO2)c(cc1OCc1ccccc1Cl)Br
InChI=1SC23H21BrClNO4S2c12819915(17(24)1120(19)301314523718(14)25)102122(27)26(23(31)3221)12166482916h235791116H4681213H21H3b2110
MFCD05150005
ZINC000100319221
ZINC000100319227
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