Vitas-M small molecule compound
(5Z)-3-(2-chloro-6-fluorobenzyl)-5-{3-methoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazolidine-2,4-dione
Catalog ID
STL379024
SMILES COc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])/C=C/1\SC(=O)N(C1=O)Cc1c(F)cccc1Cl
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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 C25H18ClFN2O6S MW 528.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClFN2O6S/c1-34-22-11-16(7-10-21(22)35-14-15-5-8-17(9-6-15)29(32)33)12-23-24(30)28(25(31)36-23)13-18-19(26)3-2-4-20(18)27/h2-12H,13-14H2,1H3/b23-12-InChIKey
WCCAMAFKRQNVFZ-FMCGGJTJSA-NSynonyms
(5Z)3((2chloro6fluorophenyl)methyl)5((3methoxy4((4nitrophenyl)methoxy)phenyl)methylidene)13thiazolidine24dione
(5Z)3(2chloro6fluorobenzyl)5(3methoxy4((4nitrobenzyl)oxy)benzylidene)13thiazolidine24dione
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=C(C=CC=C3Cl)F)OCC4=CC=C(C=C4)(N+)(=O)(O)
COc1cc(ccc1OCc1ccc(cc1)(N+)(=O)(O))C=C1SC(=O)N(C1=O)Cc1c(F)cccc1Cl
InChI=1SC25H18ClFN2O6Sc134221116(71021(22)3514155817(9615)29(32)33)122324(30)28(25(31)3623)131819(26)32420(18)27h212H1314H21H3b2312
MFCD28951021
ZINC000105979418
ZINC105979418
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