Vitas-M small molecule compound

(5E)-5-{3-bromo-4-[(4-fluorobenzyl)oxy]-5-methoxybenzylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK081296
SMILES C=CCN1C(=S)S/C(=C/c2cc(Br)c(c(c2)OC)OCc2ccc(cc2)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 C21H17BrFNO3S2 MW 494.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrFNO3S2/c1-3-8-24-20(25)18(29-21(24)28)11-14-9-16(22)19(17(10-14)26-2)27-12-13-4-6-15(23)7-5-13/h3-7,9-11H,1,8,12H2,2H3/b18-11+
InChIKey
DIDBJUMGZARIHY-WOJGMQOQSA-N
Synonyms
6213-31-6
(5E)5((3BROMO4((4FLUOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(3BROMO4((4FLUOROBENZYL)OXY)5METHOXYBENZYLIDENE)3(PROP2EN1YL)2THIOXO13THIAZOLIDIN4ONE
6213316
C=CCN1C(=S)SC(=Cc2cc(Br)c(c(c2)OC)OCc2ccc(cc2)F)C1=O
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CC=C)Br)OCC3=CC=C(C=C3)F
InChI=1SC21H17BrFNO3S2c1382420(25)18(2921(24)28)1114916(22)19(17(1014)262)2712134615(23)7513h37911H1812H22H3b1811+
MFCD02121706
STK081296
ZINC000013893166
ZINC13893166

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Available files

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