Vitas-M small molecule compound
5-[(3,5-dimethylphenoxy)methyl]-4-ethyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK443087
SMILES CCn1c(COc2cc(C)cc(c2)C)nnc1S
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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 C13H17N3OS MW 263.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3OS/c1-4-16-12(14-15-13(16)18)8-17-11-6-9(2)5-10(3)7-11/h5-7H,4,8H2,1-3H3,(H,15,18)InChIKey
KLWQAJFLTRDFOU-UHFFFAOYSA-NSynonyms
667413-42-53((35DIMETHYLPHENOXY)METHYL)4ETHYL1H124TRIAZOLE5THIONE
5((35DIMETHYLPHENOXY)METHYL)4ETHYL124TRIAZOLE3THIOL
5((35dimethylphenoxy)methyl)4ethyl4H124triazole3thiol
5(35DIMETHYLPHENOXYMETHYL)4ETHYL124TRIAZOLE3THIOL
667413425
CCN1C(=NNC1=S)COC2=CC(=CC(=C2)C)C
InChI=1SC13H17N3OSc141612(141513(16)18)8171169(2)510(3)711h57H48H213H3(H1518)
MFCD04054606
ZINC000002526641
ZINC02526641
ZINC2526641
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