Vitas-M small molecule compound

5-benzyl-4-(2,5-dimethoxyphenyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STL510067
SMILES COc1ccc(c(c1)n1c(S)nnc1Cc1ccccc1)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 C17H17N3O2S MW 327.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O2S/c1-21-13-8-9-15(22-2)14(11-13)20-16(18-19-17(20)23)10-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3,(H,19,23)
InChIKey
QZNGOLZTWXNCJL-UHFFFAOYSA-N
Synonyms
488853-50-5
3benzyl4(25dimethoxyphenyl)1~(H)124triazole5thione
488853505
5benzyl4(25dimethoxyphenyl)4H124triazole3thiol
891658
MFCD02854340

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Available files

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