5-[6-bromo-2-(4-tert-butylphenyl)-4-quinolinyl]-4-ethyl-4H-1,2,4-triazole-3-thiol

SpectraBase Compound ID	Iej7bZeBywQ
InChI	InChI=1S/C23H23BrN4S/c1-5-28-21(26-27-22(28)29)18-13-20(25-19-11-10-16(24)12-17(18)19)14-6-8-15(9-7-14)23(2,3)4/h6-13H,5H2,1-4H3,(H,27,29)
InChIKey	ZMGCJRIPTHJBQO-UHFFFAOYSA-N Google Search
Mol Weight	467.43 g/mol
Molecular Formula	C23H23BrN4S
Exact Mass	466.082681 g/mol

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SpectraBase Spectrum ID	493vreXhtkE
Name	5-[6-bromo-2-(4-tert-butylphenyl)-4-quinolinyl]-4-ethyl-4H-1,2,4-triazole-3-thiol
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C23H23BrN4S/c1-5-28-21(26-27-22(28)29)18-13-20(25-19-11-10-16(24)12-17(18)19)14-6-8-15(9-7-14)23(2,3)4/h6-13H,5H2,1-4H3,(H,27,29)
InChIKey	ZMGCJRIPTHJBQO-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_6548
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: UZI/1267240; Labnumber: COL1826; UZI_ID: UZI-006550
Synonyms	5-[6-bromo-2-(4-tert-butylphenyl)-4-quinolinyl]-4-ethyl-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature	318 °C