Vitas-M small molecule compound

4-(2-methoxyethyl)-5-[1-(methylsulfonyl)piperidin-3-yl]-4H-1,2,4-triazole-3-thiol

Catalog ID
STK472434
SMILES COCCn1c(S)nnc1C1CCCN(C1)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 C11H20N4O3S2 MW 320.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H20N4O3S2/c1-18-7-6-15-10(12-13-11(15)19)9-4-3-5-14(8-9)20(2,16)17/h9H,3-8H2,1-2H3,(H,13,19)
InChIKey
KITWTQWEWJMXJZ-UHFFFAOYSA-N
Synonyms

3(4(2METHOXYETHYL)5SULFANYL(124TRIAZOL3YL))1(METHYLSULFONYL)PIPERIDINE
4(2methoxyethyl)3(1methylsulfonylpiperidin3yl)1H124triazole5thione
4(2methoxyethyl)5(1(methylsulfonyl)piperidin3yl)4H124triazole3thiol
COCCN1C(=NNC1=S)C2CCCN(C2)S(=O)(=O)C
InChI=1SC11H20N4O3S2c118761510(121311(15)19)943514(89)20(216)17h9H38H212H3(H1319)
MFCD07626053
ZINC000017055408
ZINC000017055410

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.