Vitas-M small molecule compound
(5Z)-5-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-ethoxybenzylidene}-3-ethyl-2-thioxoimidazolidin-4-one
Catalog ID
STL371589
SMILES CCOc1cc(/C=C/2\NC(=S)N(C2=O)CC)cc(c1OCc1ccccc1Cl)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 C21H20BrClN2O3S MW 495.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrClN2O3S/c1-3-25-20(26)17(24-21(25)29)10-13-9-15(22)19(18(11-13)27-4-2)28-12-14-7-5-6-8-16(14)23/h5-11H,3-4,12H2,1-2H3,(H,24,29)/b17-10-InChIKey
WDNBJFBSFLRYHL-YVLHZVERSA-NSynonyms
(5Z)5((3BROMO4((2CHLOROPHENYL)METHOXY)5ETHOXYPHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3bromo4((2chlorobenzyl)oxy)5ethoxybenzylidene)3ethyl2thioxoimidazolidin4one
CCN1C(=O)C(=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3Cl)OCC)NC1=S
CCOc1cc(C=C2NC(=S)N(C2=O)CC)cc(c1OCc1ccccc1Cl)Br
InChI=1SC21H20BrClN2O3Sc132520(26)17(2421(25)29)1013915(22)19(18(1113)2742)281214756816(14)23h511H3412H212H3(H2429)b1710
MFCD03711041
ZINC000009295972
ZINC09295972
ZINC9295972
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