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

SpectraBase Compound ID	DhJj9urnS10
InChI	InChI=1S/C27H28N4O2S/c1-18-13-14-24(20(3)15-18)31-25(16-33-22-10-6-5-7-11-22)29-30-27(31)34-17-26(32)28-23-12-8-9-19(2)21(23)4/h5-15H,16-17H2,1-4H3,(H,28,32)
InChIKey	VCSJSHPNIVVIAZ-UHFFFAOYSA-N Google Search
Mol Weight	472.61 g/mol
Molecular Formula	C27H28N4O2S
Exact Mass	472.193297 g/mol

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SpectraBase Spectrum ID	2t29cFGmweJ
Name	N-(2,3-dimethylphenyl)-2-{[4-(2,4-dimethylphenyl)-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/C27H28N4O2S/c1-18-13-14-24(20(3)15-18)31-25(16-33-22-10-6-5-7-11-22)29-30-27(31)34-17-26(32)28-23-12-8-9-19(2)21(23)4/h5-15H,16-17H2,1-4H3,(H,28,32)
InChIKey	VCSJSHPNIVVIAZ-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_6439
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/11252619; Labnumber: 1324; IOH_ID: IOH-006440