Vitas-M small molecule compound
{(2E)-2-[(2E)-{4-[(2-chlorobenzyl)oxy]-3-ethoxy-5-iodobenzylidene}hydrazinylidene]-4-oxo-1,3-thiazolidin-5-yl}acetic acid
Catalog ID
STK099916
SMILES CCOc1cc(/C=N/N=C\2/SC(C(=O)N2)CC(=O)O)cc(c1OCc1ccccc1Cl)I
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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 C21H19ClIN3O5S MW 587.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClIN3O5S/c1-2-30-16-8-12(10-24-26-21-25-20(29)17(32-21)9-18(27)28)7-15(23)19(16)31-11-13-5-3-4-6-14(13)22/h3-8,10,17H,2,9,11H2,1H3,(H,27,28)(H,25,26,29)/b24-10+InChIKey
OXIBBFPQEDAECE-YSURURNPSA-NSynonyms
((2E)2((2E)(4((2CHLOROBENZYL)OXY)3ETHOXY5IODOBENZYLIDENE)HYDRAZINYLIDENE)4OXO13THIAZOLIDIN5YL)ACETICACID
2(2((2E)2((4((2chlorophenyl)methoxy)3ethoxy5iodophenyl)methylidene)hydrazinyl)4oxo13thiazol5yl)aceticacid
CCOC1=C(C(=CC(=C1)C=NNC2=NC(=O)C(S2)CC(=O)O)I)OCC3=CC=CC=C3Cl
CCOc1cc(C=NN=C2SC(C(=O)N2)CC(=O)O)cc(c1OCc1ccccc1Cl)I
InChI=1SC21H19ClIN3O5Sc123016812(102426212520(29)17(3221)918(27)28)715(23)19(16)311113534614(13)22h381017H2911H21H3(H2728)(H252629)b2410+
MFCD08671131
STK099916
ZINC000097959476
ZINC000097959477
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