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

SpectraBase Compound ID	9ORZjWdaCPm
InChI	InChI=1S/C25H24N4O2S/c1-3-15-29-23(16-31-20-13-11-18(2)12-14-20)27-28-25(29)32-17-24(30)26-22-10-6-8-19-7-4-5-9-21(19)22/h3-14H,1,15-17H2,2H3,(H,26,30)
InChIKey	BHEXROACNNWJNJ-UHFFFAOYSA-N Google Search
Mol Weight	444.55 g/mol
Molecular Formula	C25H24N4O2S
Exact Mass	444.161997 g/mol

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SpectraBase Spectrum ID	LVrXijdcwXm
Name	2-({4-allyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(1-naphthyl)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/C25H24N4O2S/c1-3-15-29-23(16-31-20-13-11-18(2)12-14-20)27-28-25(29)32-17-24(30)26-22-10-6-8-19-7-4-5-9-21(19)22/h3-14H,1,15-17H2,2H3,(H,26,30)
InChIKey	BHEXROACNNWJNJ-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11060
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: E05714; Labnumber: GRES-08854; SBI_ID: SBI-011063
Temperature	318 °C