acetic acid, [[4-(4-chlorophenyl)-3-cyano-6-methyl-5-[[(2-methylphenyl)amino]carbonyl]-2-pyridinyl]thio]-, methyl ester

SpectraBase Compound ID	8FuLxfFbN7w
InChI	InChI=1S/C24H20ClN3O3S/c1-14-6-4-5-7-19(14)28-23(30)21-15(2)27-24(32-13-20(29)31-3)18(12-26)22(21)16-8-10-17(25)11-9-16/h4-11H,13H2,1-3H3,(H,28,30)
InChIKey	LQYWREQUGZNLKH-UHFFFAOYSA-N Google Search
Mol Weight	465.96 g/mol
Molecular Formula	C24H20ClN3O3S
Exact Mass	465.09139 g/mol

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SpectraBase Spectrum ID	DjYZbvCDAR6
Name	acetic acid, [[4-(4-chlorophenyl)-3-cyano-6-methyl-5-[[(2-methylphenyl)amino]carbonyl]-2-pyridinyl]thio]-, methyl ester
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/C24H20ClN3O3S/c1-14-6-4-5-7-19(14)28-23(30)21-15(2)27-24(32-13-20(29)31-3)18(12-26)22(21)16-8-10-17(25)11-9-16/h4-11H,13H2,1-3H3,(H,28,30)
InChIKey	LQYWREQUGZNLKH-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_3517_2206
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: NMR/11238498