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

SpectraBase Compound ID	A2BCY5t4PuH
InChI	InChI=1S/C20H18ClF3N4O2S/c1-3-28-18(12-4-7-14(30-2)8-5-12)26-27-19(28)31-11-17(29)25-16-10-13(21)6-9-15(16)20(22,23)24/h4-10H,3,11H2,1-2H3,(H,25,29)
InChIKey	INYALYAJAAARAH-UHFFFAOYSA-N Google Search
Mol Weight	470.9 g/mol
Molecular Formula	C20H18ClF3N4O2S
Exact Mass	470.079109 g/mol

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SpectraBase Spectrum ID	4NAYYEqQJed
Name	N-[5-chloro-2-(trifluoromethyl)phenyl]-2-{[4-ethyl-5-(4-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/C20H18ClF3N4O2S/c1-3-28-18(12-4-7-14(30-2)8-5-12)26-27-19(28)31-11-17(29)25-16-10-13(21)6-9-15(16)20(22,23)24/h4-10H,3,11H2,1-2H3,(H,25,29)
InChIKey	INYALYAJAAARAH-UHFFFAOYSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_22757
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: D35776; Labnumber: SPABU-2560; SBI_ID: SBI-022761
Temperature	306 °C