quinoline, 2-[[[4,5-bis(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-

SpectraBase Compound ID	JPxMMNe37FX
InChI	InChI=1S/C26H22N4S/c1-3-9-20(10-4-1)17-25-28-29-26(30(25)18-21-11-5-2-6-12-21)31-19-23-16-15-22-13-7-8-14-24(22)27-23/h1-16H,17-19H2
InChIKey	FIWKQLOJDSMIGS-UHFFFAOYSA-N Google Search
Mol Weight	422.55 g/mol
Molecular Formula	C26H22N4S
Exact Mass	422.156518 g/mol

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SpectraBase Spectrum ID	3WJvttwxNCj
Name	quinoline, 2-[[[4,5-bis(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-
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/C26H22N4S/c1-3-9-20(10-4-1)17-25-28-29-26(30(25)18-21-11-5-2-6-12-21)31-19-23-16-15-22-13-7-8-14-24(22)27-23/h1-16H,17-19H2
InChIKey	FIWKQLOJDSMIGS-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7529_4400
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: NMR/17241586; Labnumber: 21c5245