Vitas-M small molecule compound

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

Catalog ID
STL041882
SMILES COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccc(c1O)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 C17H16N4O3S MW 356.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O3S/c1-23-13-7-3-5-11(9-13)16-19-20-17(25)21(16)18-10-12-6-4-8-14(24-2)15(12)22/h3-10,22H,1-2H3,(H,20,25)/b18-10+
InChIKey
OHJVALXEAMJSJT-VCHYOVAHSA-N
Synonyms
478257-66-8
4(((E)(2hydroxy3methoxyphenyl)methylidene)amino)5(3methoxyphenyl)24dihydro3H124triazole3thione
478257668
COc1cccc(c1)c1n(nH)c(=S)n1N=Cc1cccc(c1O)OC
MFCD05727284
ZINC000002219936

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Available files

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