Vitas-M small molecule compound

3-[1-(methylsulfonyl)piperidin-3-yl]-6-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STL506825
SMILES CS(=O)(=O)N1CCCC(C1)c1nnc2n1nc(s2)Cc1ccc2c(c1)CCCC2

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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 C20H25N5O2S2 MW 431.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O2S2/c1-29(26,27)24-10-4-7-17(13-24)19-21-22-20-25(19)23-18(28-20)12-14-8-9-15-5-2-3-6-16(15)11-14/h8-9,11,17H,2-7,10,12-13H2,1H3
InChIKey
RMIFTCCZOQDKNQ-UHFFFAOYSA-N
Synonyms

131953376
3(1(methylsulfonyl)piperidin3yl)6(5678tetrahydronaphthalen2ylmethyl)(124)triazolo(34b)(134)thiadiazole
3(1methylsulfonylpiperidin3yl)6(5678tetrahydronaphthalen2ylmethyl)(124)triazolo(34b)(134)thiadiazole
InChI=1SC20H25N5O2S2c129(2627)24104717(1324)1921222025(19)2318(2820)12148915523616(15)1114h891117H27101213H21H3
MFCD31580350
ZINC000951726952
ZINC000951726956

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Available files

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