Vitas-M small molecule compound
4-(1-benzyl-1H-pyrazol-4-yl)-5-[1-(methylsulfonyl)piperidin-4-yl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STL398128
SMILES Sc1nnc(n1c1cnn(c1)Cc1ccccc1)C1CCN(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 C18H22N6O2S2 MW 418.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6O2S2/c1-28(25,26)23-9-7-15(8-10-23)17-20-21-18(27)24(17)16-11-19-22(13-16)12-14-5-3-2-4-6-14/h2-6,11,13,15H,7-10,12H2,1H3,(H,21,27)InChIKey
LNOJBIPFSQCQPW-UHFFFAOYSA-NSynonyms
1005556-07-91005556079
4(1BENZYL1HPYRAZOL4YL)5(1(METHYLSULFONYL)PIPERIDIN4YL)4H124TRIAZOLE3THIOL
4(1benzylpyrazol4yl)3(1methylsulfonylpiperidin4yl)1H124triazole5thione
CS(=O)(=O)N1CCC(CC1)C2=NNC(=S)N2C3=CN(N=C3)CC4=CC=CC=C4
InChI=1SC18H22N6O2S2c128(2526)239715(81023)17202118(27)24(17)16111922(1316)12145324614h26111315H71012H21H3(H2127)
MFCD04137776
ZINC000002809265
ZINC02809265
ZINC2809265
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