Vitas-M small molecule compound

5-(3-tert-butyl-1H-pyrazol-5-yl)-4-(2-fluorophenyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK781836
SMILES Fc1ccccc1n1c(S)nnc1c1[nH]nc(c1)C(C)(C)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 C15H16FN5S MW 317.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16FN5S/c1-15(2,3)12-8-10(17-18-12)13-19-20-14(22)21(13)11-7-5-4-6-9(11)16/h4-8H,1-3H3,(H,17,18)(H,20,22)
InChIKey
YTLNIDBFYDTLOV-UHFFFAOYSA-N
Synonyms
879429-59-1
5(3(tertbutyl)1Hpyrazol5yl)4(2fluorophenyl)4H124triazole3thiol
5(3tertbutyl1Hpyrazol5yl)4(2fluorophenyl)4H124triazole3thiol
Fc1ccccc1n1c(S)nnc1c1(nH)nc(c1)C(C)(C)C
MFCD06016082
ZINC000009010147

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Available files

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