Vitas-M small molecule compound
4-(1-benzyl-1H-pyrazol-4-yl)-5-{1-[(1-methyl-1H-pyrazol-4-yl)sulfonyl]piperidin-3-yl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK311581
SMILES Cn1ncc(c1)S(=O)(=O)N1CCCC(C1)c1nnc(n1c1cnn(c1)Cc1ccccc1)S
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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 C21H24N8O2S2 MW 484.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N8O2S2/c1-26-15-19(11-22-26)33(30,31)28-9-5-8-17(13-28)20-24-25-21(32)29(20)18-10-23-27(14-18)12-16-6-3-2-4-7-16/h2-4,6-7,10-11,14-15,17H,5,8-9,12-13H2,1H3,(H,25,32)InChIKey
ULPMSKXXKGTFLL-UHFFFAOYSA-NSynonyms
1005690-78-71005690787
4(1benzyl1Hpyrazol4yl)5(1((1methyl1Hpyrazol4yl)sulfonyl)piperidin3yl)4H124triazole3thiol
4(1benzylpyrazol4yl)3(1(1methylpyrazol4yl)sulfonylpiperidin3yl)1H124triazole5thione
CN1C=C(C=N1)S(=O)(=O)N2CCCC(C2)C3=NNC(=S)N3C4=CN(N=C4)CC5=CC=CC=C5
InChI=1SC21H24N8O2S2c1261519(112226)33(3031)2895817(1328)20242521(32)29(20)18102327(1418)12166324716h24671011141517H5891213H21H3(H2532)
MFCD04138271
ZINC000002809757
ZINC000002809758
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