Vitas-M small molecule compound
(5Z)-5-{3-bromo-4-[(3-fluorobenzyl)oxy]benzylidene}-3-(2-methylpropyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL369599
SMILES CC(CN1C(=S)S/C(=C\c2ccc(c(c2)Br)OCc2cccc(c2)F)/C1=O)C
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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 C21H19BrFNO2S2 MW 480.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrFNO2S2/c1-13(2)11-24-20(25)19(28-21(24)27)10-14-6-7-18(17(22)9-14)26-12-15-4-3-5-16(23)8-15/h3-10,13H,11-12H2,1-2H3/b19-10-InChIKey
PECMTKUEXDJBAQ-GRSHGNNSSA-NSynonyms
(5Z)5((3BROMO4((3FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)3(2METHYLPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(3bromo4((3fluorobenzyl)oxy)benzylidene)3(2methylpropyl)2thioxo13thiazolidin4one
CC(C)CN1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC(=CC=C3)F)Br)SC1=S
CC(CN1C(=S)SC(=Cc2ccc(c(c2)Br)OCc2cccc(c2)F)C1=O)C
InChI=1SC21H19BrFNO2S2c113(2)112420(25)19(2821(24)27)10146718(17(22)914)26121543516(23)815h31013H1112H212H3b1910
MFCD03716724
ZINC000002821448
ZINC02821448
ZINC2821448
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