Vitas-M small molecule compound

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

Catalog ID
STL050518
SMILES COc1cc(ccc1O)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

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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 C16H13ClN4O2S MW 360.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN4O2S/c1-23-14-8-10(6-7-13(14)22)9-18-21-15(19-20-16(21)24)11-4-2-3-5-12(11)17/h2-9,22H,1H3,(H,20,24)/b18-9+
InChIKey
IOSJUBUBSXEPHS-GIJQJNRQSA-N
Synonyms
478254-19-2
478254192
5(2chlorophenyl)4(((E)(4hydroxy3methoxyphenyl)methylidene)amino)24dihydro3H124triazole3thione
COc1cc(ccc1O)C=Nn1c(=S)(nH)nc1c1ccccc1Cl
MFCD05729413
ZINC000001478744

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Available files

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