Vitas-M small molecule compound

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

Catalog ID
STK564530
SMILES Brc1ccc(c(c1)/C=N/n1c(COc2ccccc2)n[nH]c1=S)O

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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 C16H13BrN4O2S MW 405.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrN4O2S/c17-12-6-7-14(22)11(8-12)9-18-21-15(19-20-16(21)24)10-23-13-4-2-1-3-5-13/h1-9,22H,10H2,(H,20,24)/b18-9+
InChIKey
PZFTVEHSQOZBCZ-GIJQJNRQSA-N
Synonyms
488718-22-5
4(((E)(5bromo2hydroxyphenyl)methylidene)amino)5(phenoxymethyl)24dihydro3H124triazole3thione
488718225
Brc1ccc(c(c1)C=Nn1c(COc2ccccc2)n(nH)c1=S)O
MFCD03795062
ZINC000001798323

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Available files

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