Vitas-M small molecule compound
5-[(3-methylphenoxy)methyl]-4-pentyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK891288
SMILES CCCCCn1c(nnc1S)COc1cccc(c1)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 C15H21N3OS MW 291.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21N3OS/c1-3-4-5-9-18-14(16-17-15(18)20)11-19-13-8-6-7-12(2)10-13/h6-8,10H,3-5,9,11H2,1-2H3,(H,17,20)InChIKey
OIRCJZSAJHMEIR-UHFFFAOYSA-NSynonyms
3((3methylphenoxy)methyl)4pentyl1H124triazole5thione
5((3methylphenoxy)methyl)4pentyl4H124triazole3thiol
CCCCCN1C(=NNC1=S)COC2=CC=CC(=C2)C
InChI=1SC15H21N3OSc134591814(161715(18)20)11191386712(2)1013h6810H35911H212H3(H1720)
MFCD09983444
ZINC000011692636
ZINC11692636
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