Vitas-M small molecule compound
4-{[(E)-(5-bromo-2-fluorophenyl)methylidene]amino}-5-(3,4-dimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL047408
SMILES COc1cc(ccc1OC)c1n[nH]c(=S)n1/N=C/c1cc(Br)ccc1F
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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 C17H14BrFN4O2S MW 437.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14BrFN4O2S/c1-24-14-6-3-10(8-15(14)25-2)16-21-22-17(26)23(16)20-9-11-7-12(18)4-5-13(11)19/h3-9H,1-2H3,(H,22,26)/b20-9+InChIKey
AODRPQIPEPHUHK-AWQFTUOYSA-NSynonyms
487033-62-5487033625
COc1cc(ccc1OC)c1n(nH)c(=S)n1N=Cc1cc(Br)ccc1F
MFCD03815773
ZINC000017179713
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