Vitas-M small molecule compound
5-(4-bromo-1,5-dimethyl-1H-pyrazol-3-yl)-4-(4-fluorophenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL396938
SMILES Fc1ccc(cc1)n1c(S)nnc1c1nn(c(c1Br)C)C
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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 C13H11BrFN5S MW 368.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11BrFN5S/c1-7-10(14)11(18-19(7)2)12-16-17-13(21)20(12)9-5-3-8(15)4-6-9/h3-6H,1-2H3,(H,17,21)InChIKey
RAOYHNZLOFCSOH-UHFFFAOYSA-NSynonyms
512812-05-43(4BROMO15DIMETHYLPYRAZOL3YL)4(4FLUOROPHENYL)1H124TRIAZOLE5THIONE
5(4BROMO15DIMETHYL1HPYRAZOL3YL)4(4FLUOROPHENYL)4H124TRIAZOLE3THIOL
512812054
CC1=C(C(=NN1C)C2=NNC(=S)N2C3=CC=C(C=C3)F)Br
InChI=1SC13H11BrFN5Sc1710(14)11(1819(7)2)12161713(21)20(12)9538(15)469h36H12H3(H1721)
MFCD03466339
ZINC000005425180
ZINC5425180
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