Vitas-M small molecule compound

4-(2,5-dimethoxyphenyl)-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK841296
SMILES COc1ccc(c(c1)n1c(=S)[nH]nc1c1cccc(c1)C)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/c1-11-5-4-6-12(9-11)16-18-19-17(23)20(16)14-10-13(21-2)7-8-15(14)22-3/h4-10H,1-3H3,(H,19,23)
InChIKey
SXZYPSMAZCHFQO-UHFFFAOYSA-N
Synonyms
488810-57-7
4(25dimethoxyphenyl)3(mtolyl)1H124triazole5(4H)thione
4(25dimethoxyphenyl)5(3methylphenyl)24dihydro3H124triazole3thione
488810577
COc1ccc(c(c1)n1c(=S)(nH)nc1c1cccc(c1)C)OC
MFCD03293407
ZINC000004888918

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Available files

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