Vitas-M small molecule compound
5-[(2-methylphenoxy)methyl]-4-pentyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK946053
SMILES CCCCCn1c(nnc1S)COc1ccccc1C
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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 C15H21N3OS MW 291.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21N3OS/c1-3-4-7-10-18-14(16-17-15(18)20)11-19-13-9-6-5-8-12(13)2/h5-6,8-9H,3-4,7,10-11H2,1-2H3,(H,17,20)InChIKey
UEKFDTBWYRITEL-UHFFFAOYSA-NSynonyms
3((2methylphenoxy)methyl)4pentyl1H124triazole5thione
5((2methylphenoxy)methyl)4pentyl4H124triazole3thiol
CCCCCN1C(=NNC1=S)COC2=CC=CC=C2C
InChI=1SC15H21N3OSc1347101814(161715(18)20)111913965812(13)2h5689H3471011H212H3(H1720)
MFCD18180702
ZINC000028295960
ZINC28295960
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