Vitas-M small molecule compound

4-(2,5-dimethylphenyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK442592
SMILES Cc1ccc(c(c1)n1cnnc1S)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 C10H11N3S MW 205.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H11N3S/c1-7-3-4-8(2)9(5-7)13-6-11-12-10(13)14/h3-6H,1-2H3,(H,12,14)
InChIKey
BWUMYJYNUHZELL-UHFFFAOYSA-N
Synonyms
669748-32-7
4(25DIMETHYLPHENYL)124TRIAZOLE3THIOL
4(25DIMETHYLPHENYL)1H124TRIAZOLE5THIONE
4(25dimethylphenyl)4H124triazole3thiol
669748327
CC1=CC(=C(C=C1)C)N2C=NNC2=S
InChI=1SC10H11N3Sc17348(2)9(57)136111210(13)14h36H12H3(H1214)
MFCD03900781
ZINC000003888198
ZINC3888198

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Available files

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