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

SpectraBase Compound ID	DYR0dQ7BJlQ
InChI	InChI=1S/C23H18Cl3N3O2S/c1-30-18-9-5-17(6-10-18)29-22(13-31-19-7-3-16(24)4-8-19)27-28-23(29)32-14-15-2-11-20(25)21(26)12-15/h2-12H,13-14H2,1H3
InChIKey	UUCILLJFLOPLRG-UHFFFAOYSA-N Google Search
Mol Weight	506.84 g/mol
Molecular Formula	C23H18Cl3N3O2S
Exact Mass	505.018531 g/mol

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SpectraBase Spectrum ID	A10DqHB03ON
Name	3-[(4-chlorophenoxy)methyl]-5-[(3,4-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/C23H18Cl3N3O2S/c1-30-18-9-5-17(6-10-18)29-22(13-31-19-7-3-16(24)4-8-19)27-28-23(29)32-14-15-2-11-20(25)21(26)12-15/h2-12H,13-14H2,1H3
InChIKey	UUCILLJFLOPLRG-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_4883
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: E08308; Labnumber: GRES-36904; SBI_ID: SBI-004885
Temperature	318 °C