Vitas-M small molecule compound
4-{[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL056100
SMILES COc1cc(/C=N/n2c(=S)[nH]nc2c2n[nH]c(c2)C)cc(c1O)Br
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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 C14H13BrN6O2S MW 409.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13BrN6O2S/c1-7-3-10(18-17-7)13-19-20-14(24)21(13)16-6-8-4-9(15)12(22)11(5-8)23-2/h3-6,22H,1-2H3,(H,17,18)(H,20,24)/b16-6+InChIKey
HHMIHOIOENFGNG-OMCISZLKSA-NSynonyms
850193-64-54(((E)(3bromo4hydroxy5methoxyphenyl)methylidene)amino)5(5methyl1Hpyrazol3yl)24dihydro3H124triazole3thione
850193645
COc1cc(C=Nn2c(=S)(nH)nc2c2n(nH)c(c2)C)cc(c1O)Br
MFCD05732674
ZINC000005690956
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