Vitas-M small molecule compound

(5Z)-5-[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)benzylidene]-3-(4-methoxybenzyl)-2-(phenylimino)-1,3-thiazolidin-4-one

Catalog ID
STK153462
SMILES CCOc1cc(/C=C/2\S/C(=N\c3ccccc3)/N(C2=O)Cc2ccc(cc2)OC)cc(c1O)CC=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 C29H28N2O4S MW 500.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O4S/c1-4-9-22-16-21(17-25(27(22)32)35-5-2)18-26-28(33)31(19-20-12-14-24(34-3)15-13-20)29(36-26)30-23-10-7-6-8-11-23/h4,6-8,10-18,32H,1,5,9,19H2,2-3H3/b26-18-,30-29?
InChIKey
QAFLFXSBKCUKOD-YHEUAIPESA-N
Synonyms

(5Z)5((3ETHOXY4HYDROXY5PROP2ENYLPHENYL)METHYLIDENE)3((4METHOXYPHENYL)METHYL)2PHENYLIMINO13THIAZOLIDIN4ONE
(5Z)5(3ETHOXY4HYDROXY5(PROP2EN1YL)BENZYLIDENE)3(4METHOXYBENZYL)2(PHENYLIMINO)13THIAZOLIDIN4ONE
5(3ALLYL5ETHOXY4HYDROXYBENZYLIDENE)3(4METHOXYBENZYL)2(PHENYLIMINO)13THIAZOLIDIN4ONE
CCOC1=CC(=CC(=C1O)CC=C)C=C2C(=O)N(C(=NC3=CC=CC=C3)S2)CC4=CC=C(C=C4)OC
CCOc1cc(C=C2SC(=Nc3ccccc3)N(C2=O)Cc2ccc(cc2)OC)cc(c1O)CC=C
InChI=1SC29H28N2O4Sc149221621(1725(27(22)32)3552)182628(33)31(1920121424(343)151320)29(3626)3023107681123h468101832H15919H223H3b26183029?
MFCD04511784
ZINC000008384262
ZINC08384262
ZINC13881061
ZINC96006182

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Available files

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