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

SpectraBase Compound ID	5qLLuj92tq2
InChI	InChI=1S/C30H25ClN4O3S/c1-37-26-15-7-22(8-16-26)29-33-34-30(35(29)25-13-9-23(31)10-14-25)39-20-28(36)32-24-11-17-27(18-12-24)38-19-21-5-3-2-4-6-21/h2-18H,19-20H2,1H3,(H,32,36)
InChIKey	IKKOUATUAWVDDE-UHFFFAOYSA-N Google Search
Mol Weight	557.07 g/mol
Molecular Formula	C30H25ClN4O3S
Exact Mass	556.13359 g/mol

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SpectraBase Spectrum ID	FOq6OOyQCiV
Name	N-[4-(benzyloxy)phenyl]-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-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/C30H25ClN4O3S/c1-37-26-15-7-22(8-16-26)29-33-34-30(35(29)25-13-9-23(31)10-14-25)39-20-28(36)32-24-11-17-27(18-12-24)38-19-21-5-3-2-4-6-21/h2-18H,19-20H2,1H3,(H,32,36)
InChIKey	IKKOUATUAWVDDE-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_17105
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: D25522; Labnumber: GRES-04598; SBI_ID: SBI-017108
Temperature	308 °C