Vitas-M small molecule compound

5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-4H-1,2,4-triazole-3-thiol

Catalog ID
STK114609
SMILES CCn1c(COc2c(C)cccc2C)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/c1-4-16-11(14-15-13(16)18)8-17-12-9(2)6-5-7-10(12)3/h5-7H,4,8H2,1-3H3,(H,15,18)
InChIKey
JODKQYKPKFRRIQ-UHFFFAOYSA-N
Synonyms
662158-99-8
3((26DIMETHYLPHENOXY)METHYL)4ETHYL1H124TRIAZOLE5THIONE
5((26DIMETHYLPHENOXY)METHYL)4ETHYL4H124TRIAZOL3YLHYDROSULFIDE
5((26DIMETHYLPHENOXY)METHYL)4ETHYL4H124TRIAZOLE3THIOL
5(26DIMETHYLPHENOXYMETHYL)4ETHYL
5(26DIMETHYLPHENOXYMETHYL)4ETHYL4H(124)TRIAZOLE3THIOL
662158998
CCN1C(=NNC1=S)COC2=C(C=CC=C2C)C
InChI=1SC13H17N3OSc141611(141513(16)18)817129(2)65710(12)3h57H48H213H3(H1518)
MFCD04128536
ZINC000006519968
ZINC6519968

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Available files

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