Vitas-M small molecule compound

(5E)-5-(3-chlorobenzylidene)-3-(2-ethylhexyl)-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK796972
SMILES CCCCC(CN1C(=S)S/C(=C/c2cccc(c2)Cl)/C1=O)CC

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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 C18H22ClNOS2 MW 367.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22ClNOS2/c1-3-5-7-13(4-2)12-20-17(21)16(23-18(20)22)11-14-8-6-9-15(19)10-14/h6,8-11,13H,3-5,7,12H2,1-2H3/b16-11+
InChIKey
HIOCZQCITFNUBG-LFIBNONCSA-N
Synonyms

(5E)5((3CHLOROPHENYL)METHYLIDENE)3(2ETHYLHEXYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(3chlorobenzylidene)3(2ethylhexyl)2thioxo13thiazolidin4one
CCCCC(CC)CN1C(=O)C(=CC2=CC(=CC=C2)Cl)SC1=S
CCCCC(CN1C(=S)SC(=Cc2cccc(c2)Cl)C1=O)CC
InChI=1SC18H22ClNOS2c135713(42)122017(21)16(2318(20)22)111486915(19)1014h681113H35712H212H3b1611+
MFCD03225787
ZINC000005862484
ZINC000005862611

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Available files

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