2-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide

SpectraBase Compound ID	4BFDsfM282v
InChI	InChI=1S/C25H23ClN4O2S/c1-16-6-4-7-17(2)23(16)27-22(31)15-33-25-29-28-24(18-8-5-9-21(14-18)32-3)30(25)20-12-10-19(26)11-13-20/h4-14H,15H2,1-3H3,(H,27,31)
InChIKey	XZEGIVAGHFZKBC-UHFFFAOYSA-N Google Search
Mol Weight	479.0 g/mol
Molecular Formula	C25H23ClN4O2S
Exact Mass	478.123025 g/mol

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SpectraBase Spectrum ID	1XoImOEO2TH
Name	2-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C25H23ClN4O2S/c1-16-6-4-7-17(2)23(16)27-22(31)15-33-25-29-28-24(18-8-5-9-21(14-18)32-3)30(25)20-12-10-19(26)11-13-20/h4-14H,15H2,1-3H3,(H,27,31)
InChIKey	XZEGIVAGHFZKBC-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11431
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: E06324; Labnumber: GRES-20527; SBI_ID: SBI-011434
Temperature	308 °C