Vitas-M small molecule compound
4-(1-benzyl-1H-pyrazol-4-yl)-5-[4-bromo-1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK311522
SMILES Sc1nnc(n1c1cnn(c1)Cc1ccccc1)c1nn(c(c1Br)C(F)(F)F)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 C17H13BrF3N7S MW 484.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrF3N7S/c1-26-14(17(19,20)21)12(18)13(25-26)15-23-24-16(29)28(15)11-7-22-27(9-11)8-10-5-3-2-4-6-10/h2-7,9H,8H2,1H3,(H,24,29)InChIKey
FVXBNNXZXIGXNI-UHFFFAOYSA-NSynonyms
1005605-56-01005605560
4(1benzyl1Hpyrazol4yl)5(4bromo1methyl5(trifluoromethyl)1Hpyrazol3yl)4H124triazole3thiol
4(1benzylpyrazol4yl)3(4bromo1methyl5(trifluoromethyl)pyrazol3yl)1H124triazole5thione
CN1C(=C(C(=N1)C2=NNC(=S)N2C3=CN(N=C3)CC4=CC=CC=C4)Br)C(F)(F)F
InChI=1SC17H13BrF3N7Sc12614(17(1920)21)12(18)13(2526)15232416(29)28(15)1172227(911)8105324610h279H8H21H3(H2429)
MFCD04138118
ZINC000002809603
ZINC02809603
ZINC2809603
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