Vitas-M small molecule compound

4-butyl-4H-1,2,4-triazole-3-thiol

Catalog ID
STK443020
SMILES CCCCn1cnnc1S

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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 C6H11N3S MW 157.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H11N3S/c1-2-3-4-9-5-7-8-6(9)10/h5H,2-4H2,1H3,(H,8,10)
InChIKey
OJCWIDAHTFNRHX-UHFFFAOYSA-N
Synonyms

3MERCAPTO4NBUTYL124TRIAZOLE
4BUTYL124TRIAZOLE3THIOL
4butyl1H124triazole5thione
4butyl4H124triazole3thiol
CCCCN1C=NNC1=S
InChI=1SC6H11N3Sc123495786(9)10h5H24H21H3(H810)
MFCD04054547
ZINC000006399510
ZINC06399510
ZINC6399510

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Available files

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