Vitas-M small molecule compound
4-[1-(2,4-dichlorobenzyl)-1H-pyrazol-4-yl]-5-[1-(methylsulfonyl)piperidin-4-yl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK311085
SMILES Clc1ccc(c(c1)Cl)Cn1ncc(c1)n1c(S)nnc1C1CCN(CC1)S(=O)(=O)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 C18H20Cl2N6O2S2 MW 487.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20Cl2N6O2S2/c1-30(27,28)25-6-4-12(5-7-25)17-22-23-18(29)26(17)15-9-21-24(11-15)10-13-2-3-14(19)8-16(13)20/h2-3,8-9,11-12H,4-7,10H2,1H3,(H,23,29)InChIKey
VUDXPVOSWNLADS-UHFFFAOYSA-NSynonyms
1005619-00-01005619000
4(1((24dichlorophenyl)methyl)pyrazol4yl)3(1methylsulfonylpiperidin4yl)1H124triazole5thione
4(1(24dichlorobenzyl)1Hpyrazol4yl)5(1(methylsulfonyl)piperidin4yl)4H124triazole3thiol
CS(=O)(=O)N1CCC(CC1)C2=NNC(=S)N2C3=CN(N=C3)CC4=C(C=C(C=C4)Cl)Cl
InChI=1SC18H20Cl2N6O2S2c130(2728)256412(5725)17222318(29)26(17)1592124(1115)10132314(19)816(13)20h23891112H4710H21H3(H2329)
MFCD04059076
ZINC000002808428
ZINC02808428
ZINC2808428
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