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

SpectraBase Compound ID	L3WHE6qJvWJ
InChI	InChI=1S/C30H25ClN4O2S/c1-21-7-9-23(10-8-21)29-33-34-30(35(29)26-15-11-24(31)12-16-26)38-20-28(36)32-25-13-17-27(18-14-25)37-19-22-5-3-2-4-6-22/h2-18H,19-20H2,1H3,(H,32,36)
InChIKey	MUAWWVPTYIKXQO-UHFFFAOYSA-N Google Search
Mol Weight	541.07 g/mol
Molecular Formula	C30H25ClN4O2S
Exact Mass	540.138675 g/mol

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SpectraBase Spectrum ID	8cLdQPDB0rd
Name	N-[4-(benzyloxy)phenyl]-2-{[4-(4-chlorophenyl)-5-(4-methylphenyl)-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/C30H25ClN4O2S/c1-21-7-9-23(10-8-21)29-33-34-30(35(29)26-15-11-24(31)12-16-26)38-20-28(36)32-25-13-17-27(18-14-25)37-19-22-5-3-2-4-6-22/h2-18H,19-20H2,1H3,(H,32,36)
InChIKey	MUAWWVPTYIKXQO-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_14379
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: D98343; Labnumber: GRES-19516; SBI_ID: SBI-014382
Temperature	308 °C