Vitas-M small molecule compound
(5Z)-5-{3-bromo-4-[(4-fluorobenzyl)oxy]-5-methoxybenzylidene}-3-(2-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STL378974
SMILES COc1cc(/C=C/2\SC(=O)N(C2=O)Cc2ccccc2[N+](=O)[O-])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 C25H18BrFN2O6S MW 573.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18BrFN2O6S/c1-34-21-11-16(10-19(26)23(21)35-14-15-6-8-18(27)9-7-15)12-22-24(30)28(25(31)36-22)13-17-4-2-3-5-20(17)29(32)33/h2-12H,13-14H2,1H3/b22-12-InChIKey
NQONIKUBZAPVGP-UUYOSTAYSA-NSynonyms
(5Z)5((3bromo4((4fluorophenyl)methoxy)5methoxyphenyl)methylidene)3((2nitrophenyl)methyl)13thiazolidine24dione
(5Z)5(3bromo4((4fluorobenzyl)oxy)5methoxybenzylidene)3(2nitrobenzyl)13thiazolidine24dione
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=CC=C3(N+)(=O)(O))Br)OCC4=CC=C(C=C4)F
COc1cc(C=C2SC(=O)N(C2=O)Cc2ccccc2(N+)(=O)(O))cc(c1OCc1ccc(cc1)F)Br
InChI=1SC25H18BrFN2O6Sc134211116(1019(26)23(21)3514156818(27)9715)122224(30)28(25(31)3622)1317423520(17)29(32)33h212H1314H21H3b2212
MFCD28951003
ZINC000105979343
ZINC105979343
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