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

SpectraBase Compound ID	9HuFTRrLuEA
InChI	InChI=1S/C21H24N4O2S/c1-5-25-20(16-11-6-7-12-17(16)27-4)23-24-21(25)28-13-18(26)22-19-14(2)9-8-10-15(19)3/h6-12H,5,13H2,1-4H3,(H,22,26)
InChIKey	VSYIEASPCCOWRR-UHFFFAOYSA-N Google Search
Mol Weight	396.51 g/mol
Molecular Formula	C21H24N4O2S
Exact Mass	396.161997 g/mol

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SpectraBase Spectrum ID	6I5VsoLEcAD
Name	N-(2,6-dimethylphenyl)-2-{[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}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/C21H24N4O2S/c1-5-25-20(16-11-6-7-12-17(16)27-4)23-24-21(25)28-13-18(26)22-19-14(2)9-8-10-15(19)3/h6-12H,5,13H2,1-4H3,(H,22,26)
InChIKey	VSYIEASPCCOWRR-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11217
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: E06297; Labnumber: GRES-20044; SBI_ID: SBI-011220
Temperature	318 °C