Vitas-M small molecule compound

(5Z)-5-{3-bromo-4-[(3-chlorobenzyl)oxy]-5-methoxybenzylidene}-3-ethyl-2-thioxoimidazolidin-4-one

Catalog ID
STL371624
SMILES CCN1C(=S)N/C(=C\c2cc(Br)c(c(c2)OC)OCc2cccc(c2)Cl)/C1=O

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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 C20H18BrClN2O3S MW 481.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrClN2O3S/c1-3-24-19(25)16(23-20(24)28)9-13-8-15(21)18(17(10-13)26-2)27-11-12-5-4-6-14(22)7-12/h4-10H,3,11H2,1-2H3,(H,23,28)/b16-9-
InChIKey
MLUKUIUWRINEGE-SXGWCWSVSA-N
Synonyms

(5Z)5((3BROMO4((3CHLOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3bromo4((3chlorobenzyl)oxy)5methoxybenzylidene)3ethyl2thioxoimidazolidin4one
CCN1C(=O)C(=CC2=CC(=C(C(=C2)Br)OCC3=CC(=CC=C3)Cl)OC)NC1=S
CCN1C(=S)NC(=Cc2cc(Br)c(c(c2)OC)OCc2cccc(c2)Cl)C1=O
InChI=1SC20H18BrClN2O3Sc132419(25)16(2320(24)28)913815(21)18(17(1013)262)27111254614(22)712h410H311H212H3(H2328)b169
MFCD03712532
ZINC000009295984
ZINC09295984
ZINC9295984

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Available files

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