Vitas-M small molecule compound

5-(3-ethoxyphenyl)-4-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK584103
SMILES CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1OC)OC)OC

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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 C20H22N4O4S MW 414.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O4S/c1-5-28-15-8-6-7-13(11-15)19-22-23-20(29)24(19)21-12-14-9-10-16(25-2)18(27-4)17(14)26-3/h6-12H,5H2,1-4H3,(H,23,29)/b21-12+
InChIKey
ZPRDPWQASZZYFJ-CIAFOILYSA-N
Synonyms
613249-62-0
613249620
CCOc1cccc(c1)c1n(nH)c(=S)n1N=Cc1ccc(c(c1OC)OC)OC
MFCD07197507
ZINC000005408633

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.