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

SpectraBase Compound ID	LkUEGWt8aZi
InChI	InChI=1S/C21H14Cl3N3S/c22-16-9-7-15(8-10-16)20-25-26-21(27(20)17-4-2-1-3-5-17)28-13-14-6-11-18(23)19(24)12-14/h1-12H,13H2
InChIKey	WKMUITVKQHGCDP-UHFFFAOYSA-N Google Search
Mol Weight	446.78 g/mol
Molecular Formula	C21H14Cl3N3S
Exact Mass	444.997402 g/mol

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SpectraBase Spectrum ID	IT6Yo8b1Wj8
Name	3-(4-chlorophenyl)-5-[(3,4-dichlorobenzyl)sulfanyl]-4-phenyl-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/C21H14Cl3N3S/c22-16-9-7-15(8-10-16)20-25-26-21(27(20)17-4-2-1-3-5-17)28-13-14-6-11-18(23)19(24)12-14/h1-12H,13H2
InChIKey	WKMUITVKQHGCDP-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_4844
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: E08235; Labnumber: GRES-36818; SBI_ID: SBI-004846
Synonyms	5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl 3,4-dichlorobenzyl sulfide
Temperature	315 °C