5-[2-(3,4-dimethylphenyl)-4-quinolinyl]-4-ethyl-4H-1,2,4-triazole-3-thiol

SpectraBase Compound ID	3AMIPKA0DPr
InChI	InChI=1S/C21H20N4S/c1-4-25-20(23-24-21(25)26)17-12-19(15-10-9-13(2)14(3)11-15)22-18-8-6-5-7-16(17)18/h5-12H,4H2,1-3H3,(H,24,26)
InChIKey	ITGLLDDUPXJLRM-UHFFFAOYSA-N Google Search
Mol Weight	360.48 g/mol
Molecular Formula	C21H20N4S
Exact Mass	360.140868 g/mol

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SpectraBase Spectrum ID	Hb19H4ZITj7
Name	5-[2-(3,4-dimethylphenyl)-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/C21H20N4S/c1-4-25-20(23-24-21(25)26)17-12-19(15-10-9-13(2)14(3)11-15)22-18-8-6-5-7-16(17)18/h5-12H,4H2,1-3H3,(H,24,26)
InChIKey	ITGLLDDUPXJLRM-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_6547
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/1026361; Labnumber: COL1824; UZI_ID: UZI-006549
Synonyms	5-[2-(3,4-dimethylphenyl)-4-quinolinyl]-4-ethyl-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature	318 °C