Vitas-M small molecule compound
(5Z)-5-{3-chloro-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzylidene}-3-ethyl-1-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL380537
SMILES CCOc1cc(/C=C\2/C(=O)N(C(=S)N2C)CC)cc(c1OCc1cccc(c1)F)Cl
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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 C22H22ClFN2O3S MW 448.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClFN2O3S/c1-4-26-21(27)18(25(3)22(26)30)11-15-10-17(23)20(19(12-15)28-5-2)29-13-14-7-6-8-16(24)9-14/h6-12H,4-5,13H2,1-3H3/b18-11-InChIKey
CFWHJRWVODZVCL-WQRHYEAKSA-NSynonyms
(5Z)5((3CHLORO5ETHOXY4((3FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)3ETHYL1METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3chloro5ethoxy4((3fluorobenzyl)oxy)benzylidene)3ethyl1methyl2thioxoimidazolidin4one
CCN1C(=O)C(=CC2=CC(=C(C(=C2)Cl)OCC3=CC(=CC=C3)F)OCC)N(C1=S)C
CCOc1cc(C=C2C(=O)N(C(=S)N2C)CC)cc(c1OCc1cccc(c1)F)Cl
InChI=1SC22H22ClFN2O3Sc142621(27)18(25(3)22(26)30)11151017(23)20(19(1215)2852)29131476816(24)914h612H4513H213H3b1811
MFCD03716398
ZINC000009296124
ZINC09296124
ZINC9296124
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