Vitas-M small molecule compound

5-hexyl-4-methyl-4H-1,2,4-triazole-3-thiol

Catalog ID
STK438849
SMILES CCCCCCc1nnc(n1C)S

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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 C9H17N3S MW 199.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H17N3S/c1-3-4-5-6-7-8-10-11-9(13)12(8)2/h3-7H2,1-2H3,(H,11,13)
InChIKey
AUFAWIILZVUJLW-UHFFFAOYSA-N
Synonyms
69480-45-1
3HEXYL4METHYL1H124TRIAZOLE5THIONE
5HEXYL4METHYL124TRIAZOLE3THIOL
5hexyl4methyl4H124triazole3thiol
69480451
CCCCCCC1=NNC(=S)N1C
InChI=1SC9H17N3Sc134567810119(13)12(8)2h37H212H3(H1113)
MFCD03945674
ZINC000016957886
ZINC16957886

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Available files

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