Vitas-M small molecule compound
(5Z)-5-{2-bromo-4-[(4-fluorobenzyl)oxy]-5-methoxybenzylidene}-3-ethyl-2-thioxoimidazolidin-4-one
Catalog ID
STL371616
SMILES CCN1C(=S)N/C(=C\c2cc(OC)c(cc2Br)OCc2ccc(cc2)F)/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 C20H18BrFN2O3S MW 465.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrFN2O3S/c1-3-24-19(25)16(23-20(24)28)8-13-9-17(26-2)18(10-15(13)21)27-11-12-4-6-14(22)7-5-12/h4-10H,3,11H2,1-2H3,(H,23,28)/b16-8-InChIKey
SLUJQYAHBOCDNK-PXNMLYILSA-NSynonyms
(5Z)5((2BROMO4((4FLUOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(2bromo4((4fluorobenzyl)oxy)5methoxybenzylidene)3ethyl2thioxoimidazolidin4one
CCN1C(=O)C(=CC2=CC(=C(C=C2Br)OCC3=CC=C(C=C3)F)OC)NC1=S
CCN1C(=S)NC(=Cc2cc(OC)c(cc2Br)OCc2ccc(cc2)F)C1=O
InChI=1SC20H18BrFN2O3Sc132419(25)16(2320(24)28)813917(262)18(1015(13)21)2711124614(22)7512h410H311H212H3(H2328)b168
MFCD03711855
ZINC000009295978
ZINC09295978
ZINC9295978
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