Vitas-M small molecule compound

4-butyl-5-(2-methylfuran-3-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK449458
SMILES CCCCn1c(S)nnc1c1ccoc1C

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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 C11H15N3OS MW 237.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H15N3OS/c1-3-4-6-14-10(12-13-11(14)16)9-5-7-15-8(9)2/h5,7H,3-4,6H2,1-2H3,(H,13,16)
InChIKey
FZXSTUSBNNLYRV-UHFFFAOYSA-N
Synonyms

4BUTYL3(2METHYL3FURANYL)1H124TRIAZOLE5THIONE
4BUTYL3(2METHYL3FURYL)1H124TRIAZOLE5THIONE
4BUTYL3(2METHYLFURAN3YL)1H124TRIAZOLE5THIONE
4BUTYL5(2METHYL(3FURYL))124TRIAZOLE3THIOL
4BUTYL5(2METHYL3FURYL)4H124TRIAZOLE3THIOL
4butyl5(2methylfuran3yl)4H124triazole3thiol
CCCCN1C(=NNC1=S)C2=C(OC=C2)C
InChI=1SC11H15N3OSc13461410(121311(14)16)957158(9)2h57H346H212H3(H1316)
MFCD03467295
ZINC000005898054
ZINC05898054
ZINC5898054

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.