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

SpectraBase Compound ID	2nOBHDjsSMR
InChI	InChI=1S/C26H24N4O2S/c1-3-16-30-25(20-9-7-8-19(2)17-20)28-29-26(30)33-18-24(31)27-21-12-14-23(15-13-21)32-22-10-5-4-6-11-22/h3-15,17H,1,16,18H2,2H3,(H,27,31)
InChIKey	QWYCPZVMRJZGQW-UHFFFAOYSA-N Google Search
Mol Weight	456.56 g/mol
Molecular Formula	C26H24N4O2S
Exact Mass	456.161997 g/mol

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SpectraBase Spectrum ID	HO3oACmFgyY
Name	2-{[4-allyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)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/C26H24N4O2S/c1-3-16-30-25(20-9-7-8-19(2)17-20)28-29-26(30)33-18-24(31)27-21-12-14-23(15-13-21)32-22-10-5-4-6-11-22/h3-15,17H,1,16,18H2,2H3,(H,27,31)
InChIKey	QWYCPZVMRJZGQW-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11281
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: E06579; Labnumber: GRES-25195; SBI_ID: SBI-011284
Temperature	308 °C