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

SpectraBase Compound ID	GyxizcXtBMg
InChI	InChI=1S/C25H24N4O2S/c1-19-12-14-21(15-13-19)29-23(17-31-22-10-6-3-7-11-22)27-28-25(29)32-18-24(30)26-16-20-8-4-2-5-9-20/h2-15H,16-18H2,1H3,(H,26,30)
InChIKey	MLLZNYVBWYSVBL-UHFFFAOYSA-N Google Search
Mol Weight	444.55 g/mol
Molecular Formula	C25H24N4O2S
Exact Mass	444.161997 g/mol

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SpectraBase Spectrum ID	KhJk0Ff2kIS
Name	N-benzyl-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/C25H24N4O2S/c1-19-12-14-21(15-13-19)29-23(17-31-22-10-6-3-7-11-22)27-28-25(29)32-18-24(30)26-16-20-8-4-2-5-9-20/h2-15H,16-18H2,1H3,(H,26,30)
InChIKey	MLLZNYVBWYSVBL-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_5633
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/11221595; Labnumber: 0537; IOH_ID: IOH-005634