N-(3-chlorophenyl)-2-({4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

SpectraBase Compound ID	5MSDMFiP47T
InChI	InChI=1S/C20H21ClN4O2S/c1-3-25-18(12-27-17-9-7-14(2)8-10-17)23-24-20(25)28-13-19(26)22-16-6-4-5-15(21)11-16/h4-11H,3,12-13H2,1-2H3,(H,22,26)
InChIKey	FJBCTDFVEIBJIF-UHFFFAOYSA-N Google Search
Mol Weight	416.93 g/mol
Molecular Formula	C20H21ClN4O2S
Exact Mass	416.107375 g/mol

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SpectraBase Spectrum ID	G5nEayXj55g
Name	N-(3-chlorophenyl)-2-({4-ethyl-5-[(4-methylphenoxy)methyl]-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/C20H21ClN4O2S/c1-3-25-18(12-27-17-9-7-14(2)8-10-17)23-24-20(25)28-13-19(26)22-16-6-4-5-15(21)11-16/h4-11H,3,12-13H2,1-2H3,(H,22,26)
InChIKey	FJBCTDFVEIBJIF-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11061
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: E05720; Labnumber: GRES-08966; SBI_ID: SBI-011064
Temperature	318 °C