Vitas-M small molecule compound
(5Z)-3-(2-bromobenzyl)-5-{3-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]benzylidene}-1,3-thiazolidine-2,4-dione
Catalog ID
STL380602
SMILES O=C1S/C(=C\c2cccc(c2)Oc2nc(Cl)ncc2F)/C(=O)N1Cc1ccccc1Br
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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 C21H12BrClFN3O3S MW 520.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12BrClFN3O3S/c22-15-7-2-1-5-13(15)11-27-19(28)17(31-21(27)29)9-12-4-3-6-14(8-12)30-18-16(24)10-25-20(23)26-18/h1-10H,11H2/b17-9-InChIKey
KXQBVPGRTBYTJW-MFOYZWKCSA-NSynonyms
(5Z)3((2bromophenyl)methyl)5((3(2chloro5fluoropyrimidin4yl)oxyphenyl)methylidene)13thiazolidine24dione
(5Z)3(2bromobenzyl)5(3((2chloro5fluoropyrimidin4yl)oxy)benzylidene)13thiazolidine24dione
C1=CC=C(C(=C1)CN2C(=O)C(=CC3=CC(=CC=C3)OC4=NC(=NC=C4F)Cl)SC2=O)Br
InChI=1SC21H12BrClFN3O3Sc2215721513(15)112719(28)17(3121(27)29)91243614(812)301816(24)102520(23)2618h110H11H2b179
MFCD07065589
O=C1SC(=Cc2cccc(c2)Oc2nc(Cl)ncc2F)C(=O)N1Cc1ccccc1Br
ZINC000105981299
ZINC105981299
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