Vitas-M small molecule compound
5-cyclohexyl-4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL036876
SMILES COc1c(cccc1OC)/C=N/n1c(=S)[nH]nc1C1CCCCC1
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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 C17H22N4O2S MW 346.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O2S/c1-22-14-10-6-9-13(15(14)23-2)11-18-21-16(19-20-17(21)24)12-7-4-3-5-8-12/h6,9-12H,3-5,7-8H2,1-2H3,(H,20,24)/b18-11+InChIKey
SBIRMASERGRSSS-WOJGMQOQSA-NSynonyms
488709-72-43CYCLOHEXYL4((E)(23DIMETHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
488709724
5cyclohexyl4(((E)(23dimethoxyphenyl)methylidene)amino)24dihydro3H124triazole3thione
COc1c(cccc1OC)C=Nn1c(=S)(nH)nc1C1CCCCC1
InChI=1SC17H22N4O2Sc12214106913(15(14)232)11182116(192017(21)24)127435812h6912H3578H212H3(H2024)b1811+
MFCD03799458
ZINC000005911455
ZINC13109277
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