Vitas-M small molecule compound

(5Z)-5-(3-bromobenzylidene)-3-butyl-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK861597
SMILES CCCCN1C(=S)S/C(=C\c2cccc(c2)Br)/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 C14H14BrNOS2 MW 356.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14BrNOS2/c1-2-3-7-16-13(17)12(19-14(16)18)9-10-5-4-6-11(15)8-10/h4-6,8-9H,2-3,7H2,1H3/b12-9-
InChIKey
QOQPYNNYCKTIPB-XFXZXTDPSA-N
Synonyms

(5Z)5((3BROMOPHENYL)METHYLIDENE)3BUTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(3bromobenzylidene)3butyl2thioxo13thiazolidin4one
5((Z)3BROMOBENZYLIDENE)3BUTYL2THIOXOTHIAZOLIDINE4ONE
CCCCN1C(=O)C(=CC2=CC(=CC=C2)Br)SC1=S
CCCCN1C(=S)SC(=Cc2cccc(c2)Br)C1=O
InChI=1SC14H14BrNOS2c12371613(17)12(1914(16)18)91054611(15)810h4689H237H21H3b129
MFCD01458514
ZINC000002706873
ZINC02706873
ZINC2706873

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Available files

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