Vitas-M small molecule compound
4-(1-benzyl-1H-pyrazol-4-yl)-5-{1-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propan-2-yl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK311230
SMILES Sc1nnc(n1c1cnn(c1)Cc1ccccc1)C(Cn1nc(cc1C)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 C20H20F3N7S MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F3N7S/c1-13(10-29-14(2)8-17(27-29)20(21,22)23)18-25-26-19(31)30(18)16-9-24-28(12-16)11-15-6-4-3-5-7-15/h3-9,12-13H,10-11H2,1-2H3,(H,26,31)InChIKey
LOEFRDRUBKFZQK-UHFFFAOYSA-NSynonyms
1005671-24-81005671248
4(1benzyl1Hpyrazol4yl)5(1(5methyl3(trifluoromethyl)1Hpyrazol1yl)propan2yl)4H124triazole3thiol
4(1benzylpyrazol4yl)3(1(5methyl3(trifluoromethyl)pyrazol1yl)propan2yl)1H124triazole5thione
CC1=CC(=NN1CC(C)C2=NNC(=S)N2C3=CN(N=C3)CC4=CC=CC=C4)C(F)(F)F
InChI=1SC20H20F3N7Sc113(102914(2)817(2729)20(2122)23)18252619(31)30(18)1692428(1216)11156435715h391213H1011H212H3(H2631)
MFCD04059460
ZINC000002808781
ZINC000002808782
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