Vitas-M small molecule compound

(5Z)-5-{3-bromo-4-[(3-fluorobenzyl)oxy]benzylidene}-3-(2-methoxyethyl)-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STL369240
SMILES COCCN1C(=S)S/C(=C\c2ccc(c(c2)Br)OCc2cccc(c2)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 C20H17BrFNO3S2 MW 482.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrFNO3S2/c1-25-8-7-23-19(24)18(28-20(23)27)11-13-5-6-17(16(21)10-13)26-12-14-3-2-4-15(22)9-14/h2-6,9-11H,7-8,12H2,1H3/b18-11-
InChIKey
MEGCUXGCUKXLBA-WQRHYEAKSA-N
Synonyms

(5Z)5((3BROMO4((3FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)3(2METHOXYETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(3bromo4((3fluorobenzyl)oxy)benzylidene)3(2methoxyethyl)2thioxo13thiazolidin4one
COCCN1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC(=CC=C3)F)Br)SC1=S
COCCN1C(=S)SC(=Cc2ccc(c(c2)Br)OCc2cccc(c2)F)C1=O
InChI=1SC20H17BrFNO3S2c125872319(24)18(2820(23)27)11135617(16(21)1013)26121432415(22)914h26911H7812H21H3b1811
MFCD03705116
ZINC000002946465
ZINC02946465
ZINC2946465

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Available files

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