3-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-butyl-1H-1,2,4-triazole-5-thione

SpectraBase Compound ID	E0YeVTt8U0m
InChI	InChI=1S/C13H20BrN5S/c1-4-5-7-18-11(15-16-13(18)20)6-8-19-10(3)12(14)9(2)17-19/h4-8H2,1-3H3,(H,16,20)
InChIKey	JQLPOGRHGSJBDX-UHFFFAOYSA-N Google Search
Mol Weight	358.3 g/mol
Molecular Formula	C13H20BrN5S
Exact Mass	357.06228 g/mol

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SpectraBase Spectrum ID	LjoGh8bt6Ni
Name	3-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-butyl-1H-1,2,4-triazole-5-thione
Alternate Name(s)	3-[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)ethyl]-4-butyl-1H-1,2,4-triazole-5-thione 3-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-butyl-1H-1,2,4-triazole-5-thione 5-[2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-4-butyl-4H-1,2,4-triazole-3-thiol
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H20BrN5S
InChI	InChI=1S/C13H20BrN5S/c1-4-5-7-18-11(15-16-13(18)20)6-8-19-10(3)12(14)9(2)17-19/h4-8H2,1-3H3,(H,16,20)
InChIKey	JQLPOGRHGSJBDX-UHFFFAOYSA-N
Molecular Weight	358.302 g/mol
SMILES	Sc1[n](c(nn1)CC[n]1c(c(c(n1)C)Br)C)CCCC
SPLASH	splash10-0ue9-5900000000-6e9ef9c566a1a33c9b27
Wiley ID	1452642