Vitas-M small molecule compound

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

Catalog ID
STK444568
SMILES CC(Cn1c(C)nnc1S)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 C7H13N3S MW 171.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H13N3S/c1-5(2)4-10-6(3)8-9-7(10)11/h5H,4H2,1-3H3,(H,9,11)
InChIKey
NXSCOJLLQQZSSH-UHFFFAOYSA-N
Synonyms

3methyl4(2methylpropyl)1H124triazole5thione
5METHYL4(2METHYLPROPYL)124TRIAZOLE3THIOL
5methyl4(2methylpropyl)4H124triazole3thiol
CC1=NNC(=S)N1CC(C)C
InChI=1SC7H13N3Sc15(2)4106(3)897(10)11h5H4H213H3(H911)
MFCD04057285
ZINC000006790220
ZINC06790220
ZINC6790220

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Available files

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