3-(4-chlorophenyl)-5-[(2,6-dichlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazole

SpectraBase Compound ID	2FLm6abmpdL
InChI	InChI=1S/C22H16Cl3N3OS/c1-29-17-11-9-16(10-12-17)28-21(14-5-7-15(23)8-6-14)26-27-22(28)30-13-18-19(24)3-2-4-20(18)25/h2-12H,13H2,1H3
InChIKey	XAJJUUVDYUVKKC-UHFFFAOYSA-N Google Search
Mol Weight	476.81 g/mol
Molecular Formula	C22H16Cl3N3OS
Exact Mass	475.007966 g/mol

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SpectraBase Spectrum ID	3XvBjU4TgV1
Name	3-(4-chlorophenyl)-5-[(2,6-dichlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazole
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/C22H16Cl3N3OS/c1-29-17-11-9-16(10-12-17)28-21(14-5-7-15(23)8-6-14)26-27-22(28)30-13-18-19(24)3-2-4-20(18)25/h2-12H,13H2,1H3
InChIKey	XAJJUUVDYUVKKC-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_14398
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: D98379; Labnumber: GRES-20100; SBI_ID: SBI-014401
Synonyms	4-{3-(4-chlorophenyl)-5-[(2,6-dichlorobenzyl)sulfanyl]-4H-1,2,4-triazol-4-yl}phenyl methyl ether
Temperature	308 °C