Vitas-M small molecule compound

(5Z)-3-benzyl-5-(2-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK058327
SMILES C=CCc1ccc(c(c1)OC)OCCOc1ccccc1/C=C/1\SC(=S)N(C1=O)Cc1ccccc1

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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 C29H27NO4S2 MW 517.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO4S2/c1-3-9-21-14-15-25(26(18-21)32-2)34-17-16-33-24-13-8-7-12-23(24)19-27-28(31)30(29(35)36-27)20-22-10-5-4-6-11-22/h3-8,10-15,18-19H,1,9,16-17,20H2,2H3/b27-19-
InChIKey
YBQKKGQJZLPUEF-DIBXZPPDSA-N
Synonyms

(5Z)3benzyl5((2(2(2methoxy4prop2enylphenoxy)ethoxy)phenyl)methylidene)2sulfanylidene13thiazolidin4one
(5Z)3BENZYL5(2(2(2METHOXY4(PROP2EN1YL)PHENOXY)ETHOXY)BENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
C=CCc1ccc(c(c1)OC)OCCOc1ccccc1C=C1SC(=S)N(C1=O)Cc1ccccc1
COC1=C(C=CC(=C1)CC=C)OCCOC2=CC=CC=C2C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4
InChI=1SC29H27NO4S2c13921141525(26(1821)322)341716332413871223(24)192728(31)30(29(35)3627)2022105461122h3810151819H19161720H22H3b2719
MFCD05976649
STK058327
ZINC000013896277
ZINC13896277

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Available files

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