Vitas-M small molecule compound

4-ethyl-5-(1-methyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STL301501
SMILES CCn1c(S)nnc1c1cnn(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 C8H11N5S MW 209.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H11N5S/c1-3-13-7(10-11-8(13)14)6-4-9-12(2)5-6/h4-5H,3H2,1-2H3,(H,11,14)
InChIKey
XBDCBUXAVQEGBM-UHFFFAOYSA-N
Synonyms
1174309-68-2
1174309682
4ethyl3(1methylpyrazol4yl)1H124triazole5thione
4ethyl5(1methyl1Hpyrazol4yl)4H124triazole3thiol
CCN1C(=NNC1=S)C2=CN(N=C2)C
InChI=1SC8H11N5Sc13137(10118(13)14)64912(2)56h45H3H212H3(H1114)
MFCD03421740
ZINC000006125718
ZINC6125718

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Available files

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