Vitas-M small molecule compound
{(2E)-2-[(2E)-{3-methoxy-4-[(4-methylbenzyl)oxy]benzylidene}hydrazinylidene]-4-oxo-1,3-thiazolidin-5-yl}acetic acid
Catalog ID
STL383665
SMILES COc1cc(/C=N/N=C/2\NC(=O)C(S2)CC(=O)O)ccc1OCc1ccc(cc1)C
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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 C21H21N3O5S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O5S/c1-13-3-5-14(6-4-13)12-29-16-8-7-15(9-17(16)28-2)11-22-24-21-23-20(27)18(30-21)10-19(25)26/h3-9,11,18H,10,12H2,1-2H3,(H,25,26)(H,23,24,27)/b22-11+InChIKey
KJMAMIQWUQSKNA-SSDVNMTOSA-NSynonyms
((2E)2((2E)(3methoxy4((4methylbenzyl)oxy)benzylidene)hydrazinylidene)4oxo13thiazolidin5yl)aceticacid
2(2((2E)2((3methoxy4((4methylphenyl)methoxy)phenyl)methylidene)hydrazinyl)4oxo13thiazol5yl)aceticacid
CC1=CC=C(C=C1)COC2=C(C=C(C=C2)C=NNC3=NC(=O)C(S3)CC(=O)O)OC
COc1cc(C=NN=C2NC(=O)C(S2)CC(=O)O)ccc1OCc1ccc(cc1)C
InChI=1SC21H21N3O5Sc1133514(6413)1229168715(917(16)282)112224212320(27)18(3021)1019(25)26h391118H1012H212H3(H2526)(H232427)b2211+
MFCD03140784
ZINC000006798250
ZINC000016115892
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