N-(2,3-dimethylphenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

SpectraBase Compound ID	FdpqSqtErfA
InChI	InChI=1S/C26H26N4O2S/c1-18-12-14-21(15-13-18)30-24(16-32-22-9-5-4-6-10-22)28-29-26(30)33-17-25(31)27-23-11-7-8-19(2)20(23)3/h4-15H,16-17H2,1-3H3,(H,27,31)
InChIKey	MZBPAFFTNMRGFH-UHFFFAOYSA-N Google Search
Mol Weight	458.58 g/mol
Molecular Formula	C26H26N4O2S
Exact Mass	458.177647 g/mol

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SpectraBase Spectrum ID	GYU2v3xiqjs
Name	N-(2,3-dimethylphenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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/C26H26N4O2S/c1-18-12-14-21(15-13-18)30-24(16-32-22-9-5-4-6-10-22)28-29-26(30)33-17-25(31)27-23-11-7-8-19(2)20(23)3/h4-15H,16-17H2,1-3H3,(H,27,31)
InChIKey	MZBPAFFTNMRGFH-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_5641
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/11221613; Labnumber: 0555; IOH_ID: IOH-005642