Vitas-M small molecule compound

methyl {[5-(cyclohexylmethyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate

Catalog ID
STL589496
SMILES COC(=O)CSc1nnc(n1C)CC1CCCCC1

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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 C13H21N3O2S MW 283.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H21N3O2S/c1-16-11(8-10-6-4-3-5-7-10)14-15-13(16)19-9-12(17)18-2/h10H,3-9H2,1-2H3
InChIKey
VTQQMIVMYOCZHB-UHFFFAOYSA-N
Synonyms

InChI=1SC13H21N3O2Sc11611(8106435710)141513(16)19912(17)182h10H39H212H3
methyl((5(cyclohexylmethyl)4methyl4H124triazol3yl)sulfanyl)acetate

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Available files

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