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

SpectraBase Compound ID	5cL2zHb2JXp
InChI	InChI=1S/C22H24ClN5OS/c1-15-18(23)10-5-11-19(15)25-20(29)14-30-22-27-26-21(16-7-6-12-24-13-16)28(22)17-8-3-2-4-9-17/h5-7,10-13,17H,2-4,8-9,14H2,1H3,(H,25,29)
InChIKey	LHSDACWXALDYHA-UHFFFAOYSA-N Google Search
Mol Weight	441.98 g/mol
Molecular Formula	C22H24ClN5OS
Exact Mass	441.139009 g/mol

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SpectraBase Spectrum ID	B1DZBctPgj9
Name	N-(3-chloro-2-methylphenyl)-2-{[4-cyclohexyl-5-(3-pyridinyl)-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/C22H24ClN5OS/c1-15-18(23)10-5-11-19(15)25-20(29)14-30-22-27-26-21(16-7-6-12-24-13-16)28(22)17-8-3-2-4-9-17/h5-7,10-13,17H,2-4,8-9,14H2,1H3,(H,25,29)
InChIKey	LHSDACWXALDYHA-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_18117
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: D31836; Labnumber: VGU-0022740; SBI_ID: SBI-018120
Temperature	308 °C