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

SpectraBase Compound ID	BOsuHIU2ub0
InChI	InChI=1S/C29H23ClN4O2S/c1-20-11-15-22(16-12-20)34-28(25-9-5-6-10-26(25)30)32-33-29(34)37-19-27(35)31-21-13-17-24(18-14-21)36-23-7-3-2-4-8-23/h2-18H,19H2,1H3,(H,31,35)
InChIKey	OAROFRPRMRKAHD-UHFFFAOYSA-N Google Search
Mol Weight	527.04 g/mol
Molecular Formula	C29H23ClN4O2S
Exact Mass	526.123025 g/mol

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SpectraBase Spectrum ID	2L38QTgrR2w
Name	2-{[5-(2-chlorophenyl)-4-(4-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/C29H23ClN4O2S/c1-20-11-15-22(16-12-20)34-28(25-9-5-6-10-26(25)30)32-33-29(34)37-19-27(35)31-21-13-17-24(18-14-21)36-23-7-3-2-4-8-23/h2-18H,19H2,1H3,(H,31,35)
InChIKey	OAROFRPRMRKAHD-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_4498
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: D99048; Labnumber: GRES-30650; SBI_ID: SBI-004500
Temperature	315 °C