Vitas-M small molecule compound
(5Z)-5-{3-chloro-5-ethoxy-4-[(2-fluorobenzyl)oxy]benzylidene}-3-ethyl-2-thioxoimidazolidin-4-one
Catalog ID
STL369341
SMILES CCOc1cc(/C=C/2\NC(=S)N(C2=O)CC)cc(c1OCc1ccccc1F)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 C21H20ClFN2O3S MW 434.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClFN2O3S/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
KBPWMOVVYAOBIH-YVLHZVERSA-NSynonyms
(5Z)5((3CHLORO5ETHOXY4((2FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3chloro5ethoxy4((2fluorobenzyl)oxy)benzylidene)3ethyl2thioxoimidazolidin4one
5(3CHLORO5ETHOXY4((2FLUOROBENZYL)OXY)BENZYLIDENE)3ETHYL2THIOXO4IMIDAZOLIDINONE
CCN1C(=O)C(=CC2=CC(=C(C(=C2)Cl)OCC3=CC=CC=C3F)OCC)NC1=S
CCOc1cc(C=C2NC(=S)N(C2=O)CC)cc(c1OCc1ccccc1F)Cl
InChI=1SC21H20ClFN2O3Sc132520(26)17(2421(25)29)1013915(22)19(18(1113)2742)281214756816(14)23h511H3412H212H3(H2429)b1710
MFCD03696670
ZINC000008395873
ZINC08395873
ZINC8395873
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