Vitas-M small molecule compound
4-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK570115
SMILES COc1cc(ccc1O)/C=N/n1c(=S)[nH]nc1c1[nH]nc2c1CCC2
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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 C16H16N6O2S MW 356.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6O2S/c1-24-13-7-9(5-6-12(13)23)8-17-22-15(20-21-16(22)25)14-10-3-2-4-11(10)18-19-14/h5-8,23H,2-4H2,1H3,(H,18,19)(H,21,25)/b17-8+InChIKey
VDULJFTWNBLDMB-CAOOACKPSA-NSynonyms
4(((E)(4hydroxy3methoxyphenyl)methylidene)amino)5(2456tetrahydrocyclopenta(c)pyrazol3yl)24dihydro3H124triazole3thione
COc1cc(ccc1O)C=Nn1c(=S)(nH)nc1c1(nH)nc2c1CCC2
MFCD05730603
ZINC000005457921
Check stock
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Check stock on Vitas-MAvailable files
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