Vitas-M small molecule compound

(5E)-5-{3-bromo-4-[(4-methylbenzyl)oxy]benzylidene}-3-(2-methylpropyl)-1,3-thiazolidine-2,4-dione

Catalog ID
STL364681
SMILES CC(CN1C(=O)S/C(=C/c2ccc(c(c2)Br)OCc2ccc(cc2)C)/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 C22H22BrNO3S MW 460.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrNO3S/c1-14(2)12-24-21(25)20(28-22(24)26)11-17-8-9-19(18(23)10-17)27-13-16-6-4-15(3)5-7-16/h4-11,14H,12-13H2,1-3H3/b20-11+
InChIKey
KGKPUIYVCITCQR-RGVLZGJSSA-N
Synonyms

(5E)5((3bromo4((4methylphenyl)methoxy)phenyl)methylidene)3(2methylpropyl)13thiazolidine24dione
(5E)5(3bromo4((4methylbenzyl)oxy)benzylidene)3(2methylpropyl)13thiazolidine24dione
CC(CN1C(=O)SC(=Cc2ccc(c(c2)Br)OCc2ccc(cc2)C)C1=O)C
CC1=CC=C(C=C1)COC2=C(C=C(C=C2)C=C3C(=O)N(C(=O)S3)CC(C)C)Br
InChI=1SC22H22BrNO3Sc114(2)122421(25)20(2822(24)26)11178919(18(23)1017)2713166415(3)5716h41114H1213H213H3b2011+
MFCD09476023
ZINC000009236580
ZINC09236580
ZINC9236580

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Available files

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