Vitas-M small molecule compound

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

Catalog ID
STL047630
SMILES COc1cc(ccc1O)/C=N/n1c(=S)[nH]nc1c1ccccc1C

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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 C17H16N4O2S MW 340.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O2S/c1-11-5-3-4-6-13(11)16-19-20-17(24)21(16)18-10-12-7-8-14(22)15(9-12)23-2/h3-10,22H,1-2H3,(H,20,24)/b18-10+
InChIKey
PSWJPCXLMICWNB-VCHYOVAHSA-N
Synonyms
499117-79-2
4(((E)(4hydroxy3methoxyphenyl)methylidene)amino)5(2methylphenyl)24dihydro3H124triazole3thione
499117792
COc1cc(ccc1O)C=Nn1c(=S)(nH)nc1c1ccccc1C
MFCD03796942
ZINC000001297116

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Available files

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