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

SpectraBase Compound ID	LwQQoDeQ8Ka
InChI	InChI=1S/C20H21ClN4OS/c1-4-25-19(15-7-5-6-13(2)10-15)23-24-20(25)27-12-18(26)22-17-9-8-16(21)11-14(17)3/h5-11H,4,12H2,1-3H3,(H,22,26)
InChIKey	GMSFPMZUUOGCAO-UHFFFAOYSA-N Google Search
Mol Weight	400.93 g/mol
Molecular Formula	C20H21ClN4OS
Exact Mass	400.11246 g/mol

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SpectraBase Spectrum ID	LNalJZzncpT
Name	N-(4-chloro-2-methylphenyl)-2-{[4-ethyl-5-(3-methylphenyl)-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/C20H21ClN4OS/c1-4-25-19(15-7-5-6-13(2)10-15)23-24-20(25)27-12-18(26)22-17-9-8-16(21)11-14(17)3/h5-11H,4,12H2,1-3H3,(H,22,26)
InChIKey	GMSFPMZUUOGCAO-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11378
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: E06696; Labnumber: GRES-27812; SBI_ID: SBI-011381
Temperature	318 °C