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

SpectraBase Compound ID	9A5gijJCPVb
InChI	InChI=1S/C30H26N4O3S/c1-22-12-16-24(17-13-22)34-28(20-36-25-8-4-2-5-9-25)32-33-30(34)38-21-29(35)31-23-14-18-27(19-15-23)37-26-10-6-3-7-11-26/h2-19H,20-21H2,1H3,(H,31,35)
InChIKey	BOWHVXUBXPAMCN-UHFFFAOYSA-N Google Search
Mol Weight	522.62 g/mol
Molecular Formula	C30H26N4O3S
Exact Mass	522.172562 g/mol

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SpectraBase Spectrum ID	DhkxfpApbti
Name	2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-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/C30H26N4O3S/c1-22-12-16-24(17-13-22)34-28(20-36-25-8-4-2-5-9-25)32-33-30(34)38-21-29(35)31-23-14-18-27(19-15-23)37-26-10-6-3-7-11-26/h2-19H,20-21H2,1H3,(H,31,35)
InChIKey	BOWHVXUBXPAMCN-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_5635
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/11221599; Labnumber: 0541; IOH_ID: IOH-005636