Vitas-M small molecule compound
(5E)-5-{3-bromo-4-[(4-fluorobenzyl)oxy]-5-methoxybenzylidene}-3-(2-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL369976
SMILES COc1cc(/C=C\2/SC(=S)N(C2=O)c2ccccc2C)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 C25H19BrFNO3S2 MW 544.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19BrFNO3S2/c1-15-5-3-4-6-20(15)28-24(29)22(33-25(28)32)13-17-11-19(26)23(21(12-17)30-2)31-14-16-7-9-18(27)10-8-16/h3-13H,14H2,1-2H3/b22-13+InChIKey
SXAZDJLXEDBOPW-LPYMAVHISA-NSynonyms
(5E)5((3BROMO4((4FLUOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENE)3(2METHYLPHENYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(3bromo4((4fluorobenzyl)oxy)5methoxybenzylidene)3(2methylphenyl)2thioxo13thiazolidin4one
CC1=CC=CC=C1N2C(=O)C(=CC3=CC(=C(C(=C3)Br)OCC4=CC=C(C=C4)F)OC)SC2=S
COc1cc(C=C2SC(=S)N(C2=O)c2ccccc2C)cc(c1OCc1ccc(cc1)F)Br
InChI=1SC25H19BrFNO3S2c115534620(15)2824(29)22(3325(28)32)13171119(26)23(21(1217)302)3114167918(27)10816h313H14H212H3b2213+
MFCD03905729
ZINC000100341745
ZINC100341745
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