5-[(4-tert-butylphenoxy)methyl]-4-(4-methylphenyl)-2-(1-piperidinylmethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

SpectraBase Compound ID	CP6r7UPCurp
InChI	InChI=1S/C26H34N4OS/c1-20-8-12-22(13-9-20)30-24(18-31-23-14-10-21(11-15-23)26(2,3)4)27-29(25(30)32)19-28-16-6-5-7-17-28/h8-15H,5-7,16-19H2,1-4H3
InChIKey	HJUCTSLLAFHZAU-UHFFFAOYSA-N Google Search
Mol Weight	450.6 g/mol
Molecular Formula	C26H34N4OS
Exact Mass	450.245333 g/mol

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SpectraBase Spectrum ID	DMYQaj8csbc
Name	5-[(4-tert-butylphenoxy)methyl]-4-(4-methylphenyl)-2-(1-piperidinylmethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
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/C26H34N4OS/c1-20-8-12-22(13-9-20)30-24(18-31-23-14-10-21(11-15-23)26(2,3)4)27-29(25(30)32)19-28-16-6-5-7-17-28/h8-15H,5-7,16-19H2,1-4H3
InChIKey	HJUCTSLLAFHZAU-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_5448
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/11221580; Labnumber: 0522; IOH_ID: IOH-005449