Vitas-M small molecule compound

4-ethyl-5-hexyl-4H-1,2,4-triazole-3-thiol

Catalog ID
STK438862
SMILES CCCCCCc1nnc(n1CC)S

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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 C10H19N3S MW 213.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H19N3S/c1-3-5-6-7-8-9-11-12-10(14)13(9)4-2/h3-8H2,1-2H3,(H,12,14)
InChIKey
YBAUUGYXLURPSU-UHFFFAOYSA-N
Synonyms
69480-18-8
4ETHYL3HEXYL1H124TRIAZOLE5THIONE
4ETHYL5HEXYL124TRIAZOLE3THIOL
4ethyl5hexyl4H124triazole3thiol
69480188
CCCCCCC1=NNC(=S)N1CC
InChI=1SC10H19N3Sc1356789111210(14)13(9)42h38H212H3(H1214)
MFCD03945740
ZINC000016970020
ZINC16970020

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Available files

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