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

SpectraBase Compound ID	FpZeHLojGQa
InChI	InChI=1S/C22H16Cl3N3S/c1-14-9-11-15(12-10-14)28-21(16-5-2-3-6-18(16)23)26-27-22(28)29-13-17-19(24)7-4-8-20(17)25/h2-12H,13H2,1H3
InChIKey	DTEDIAOSNDEMII-UHFFFAOYSA-N Google Search
Mol Weight	460.81 g/mol
Molecular Formula	C22H16Cl3N3S
Exact Mass	459.013052 g/mol

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SpectraBase Spectrum ID	Kjk2yE8Zvsf
Name	3-(2-chlorophenyl)-5-[(2,6-dichlorobenzyl)sulfanyl]-4-(4-methylphenyl)-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/C22H16Cl3N3S/c1-14-9-11-15(12-10-14)28-21(16-5-2-3-6-18(16)23)26-27-22(28)29-13-17-19(24)7-4-8-20(17)25/h2-12H,13H2,1H3
InChIKey	DTEDIAOSNDEMII-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_14341
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: D98224; Labnumber: GRES-17619; SBI_ID: SBI-014344
Synonyms	5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl 2,6-dichlorobenzyl sulfide
Temperature	308 °C