Vitas-M small molecule compound

5-tert-butyl-4-phenyl-4H-1,2,4-triazole-3-thiol

Catalog ID
STL509555
SMILES Sc1nnc(n1c1ccccc1)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 C12H15N3S MW 233.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3S/c1-12(2,3)10-13-14-11(16)15(10)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,14,16)
InChIKey
SKPMGVKBHVTGQH-UHFFFAOYSA-N
Synonyms
874791-21-6
3~(tert)butyl4phenyl1~(H)124triazole5thione
59257479
5tertbutyl4phenyl4H124triazole3thiol
874791216
InChI=1SC12H15N3Sc112(23)10131411(16)15(10)9754689h48H13H3(H1416)
MFCD04036102
ZINC000002523438

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Available files

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