2-({5-[(3-chloroanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4-dimethylphenyl)acetamide

SpectraBase Compound ID	Lw0EBi0Hyq7
InChI	InChI=1S/C25H24ClN5OS/c1-17-11-12-22(18(2)13-17)28-24(32)16-33-25-30-29-23(31(25)21-9-4-3-5-10-21)15-27-20-8-6-7-19(26)14-20/h3-14,27H,15-16H2,1-2H3,(H,28,32)
InChIKey	VYBWYGXBIJRMTC-UHFFFAOYSA-N Google Search
Mol Weight	478.01 g/mol
Molecular Formula	C25H24ClN5OS
Exact Mass	477.139009 g/mol

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SpectraBase Spectrum ID	DcVTrUao7S9
Name	2-({5-[(3-chloroanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4-dimethylphenyl)acetamide
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/C25H24ClN5OS/c1-17-11-12-22(18(2)13-17)28-24(32)16-33-25-30-29-23(31(25)21-9-4-3-5-10-21)15-27-20-8-6-7-19(26)14-20/h3-14,27H,15-16H2,1-2H3,(H,28,32)
InChIKey	VYBWYGXBIJRMTC-UHFFFAOYSA-N
NMR Offset	14.4793
NMR Spectrometer Frequency	500.138
Observed nucleus	1H
Origin	1H_UZI_26187_18095
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: UZI/8066173; Labnumber: STA-0004767; UZI_ID: UZI-018102
Temperature	313 °C