Vitas-M small molecule compound

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

Catalog ID
STK560954
SMILES COc1ccc(cc1OC)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 C20H22N4O5S MW 430.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O5S/c1-25-14-8-6-12(10-16(14)27-3)19-22-23-20(30)24(19)21-11-13-7-9-15(26-2)18(29-5)17(13)28-4/h6-11H,1-5H3,(H,23,30)/b21-11+
InChIKey
GWAVQNUEUYGNGW-SRZZPIQSSA-N
Synonyms
488088-59-1
488088591
COc1ccc(cc1OC)c1n(nH)c(=S)n1N=Cc1ccc(c(c1OC)OC)OC
MFCD03808439
ZINC000002325294

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Available files

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