Vitas-M small molecule compound
(5Z)-5-{3-chloro-5-ethoxy-4-[(4-fluorobenzyl)oxy]benzylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK007727
SMILES CCOc1cc(/C=C/2\SC(=S)N(C2=O)CC)cc(c1OCc1ccc(cc1)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 C21H19ClFNO3S2 MW 451.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClFNO3S2/c1-3-24-20(25)18(29-21(24)28)11-14-9-16(22)19(17(10-14)26-4-2)27-12-13-5-7-15(23)8-6-13/h5-11H,3-4,12H2,1-2H3/b18-11-InChIKey
TZLXJVGHIKVASQ-WQRHYEAKSA-NSynonyms
(5Z)5((3CHLORO5ETHOXY4((4FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(3CHLORO5ETHOXY4((4FLUOROBENZYL)OXY)BENZYLIDENE)3ETHYL2THIOXO13THIAZOLIDIN4ONE
CCN1C(=O)C(=CC2=CC(=C(C(=C2)Cl)OCC3=CC=C(C=C3)F)OCC)SC1=S
CCOc1cc(C=C2SC(=S)N(C2=O)CC)cc(c1OCc1ccc(cc1)F)Cl
InChI=1SC21H19ClFNO3S2c132420(25)18(2921(24)28)1114916(22)19(17(1014)2642)2712135715(23)8613h511H3412H212H3b1811
MFCD03227543
STK007727
ZINC000002962778
ZINC02962778
ZINC2962778
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