3-[5-[(3-chlorobenzyl)sulfanyl]-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]phenyl methyl ether

SpectraBase Compound ID	GgCYcof9lmh
InChI	InChI=1S/C22H17Cl2N3OS/c1-28-20-7-3-5-16(13-20)21-25-26-22(27(21)19-10-8-17(23)9-11-19)29-14-15-4-2-6-18(24)12-15/h2-13H,14H2,1H3
InChIKey	CFIWMUBSACVQLD-UHFFFAOYSA-N Google Search
Mol Weight	442.36 g/mol
Molecular Formula	C22H17Cl2N3OS
Exact Mass	441.046939 g/mol

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SpectraBase Spectrum ID	GpXAASKacwS
Name	3-[5-[(3-chlorobenzyl)sulfanyl]-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]phenyl methyl ether
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/C22H17Cl2N3OS/c1-28-20-7-3-5-16(13-20)21-25-26-22(27(21)19-10-8-17(23)9-11-19)29-14-15-4-2-6-18(24)12-15/h2-13H,14H2,1H3
InChIKey	CFIWMUBSACVQLD-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_4896
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: E08330; Labnumber: GRES-36930; SBI_ID: SBI-004898
Synonyms	3-[(3-chlorobenzyl)sulfanyl]-4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazole
Temperature	318 °C