Vitas-M small molecule compound
(5E)-5-{2-bromo-5-methoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-3-(3-chloro-4-fluorophenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK320425
SMILES COc1cc(/C=C\2/SC(=S)N(C2=O)c2ccc(c(c2)Cl)F)c(cc1OCc1ccc(cc1)[N+](=O)[O-])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 C24H15BrClFN2O5S2 MW 609.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H15BrClFN2O5S2/c1-33-20-8-14(17(25)11-21(20)34-12-13-2-4-15(5-3-13)29(31)32)9-22-23(30)28(24(35)36-22)16-6-7-19(27)18(26)10-16/h2-11H,12H2,1H3/b22-9+InChIKey
FEFJSMAADUYCRO-LSFURLLWSA-NSynonyms
(5E)5((2bromo5methoxy4((4nitrophenyl)methoxy)phenyl)methylidene)3(3chloro4fluorophenyl)2sulfanylidene13thiazolidin4one
(5E)5(2BROMO5METHOXY4((4NITROBENZYL)OXY)BENZYLIDENE)3(3CHLORO4FLUOROPHENYL)2THIOXO13THIAZOLIDIN4ONE
COC1=C(C=C(C(=C1)C=C2C(=O)N(C(=S)S2)C3=CC(=C(C=C3)F)Cl)Br)OCC4=CC=C(C=C4)(N+)(=O)(O)
COc1cc(C=C2SC(=S)N(C2=O)c2ccc(c(c2)Cl)F)c(cc1OCc1ccc(cc1)(N+)(=O)(O))Br
InChI=1SC24H15BrClFN2O5S2c13320814(17(25)1121(20)3412132415(5313)29(31)32)92223(30)28(24(35)3622)166719(27)18(26)1016h211H12H21H3b229+
MFCD03614351
ZINC000100327519
ZINC100327519
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