1-imidazolidineacetic acid, 3-(4-chlorophenyl)-5-[2-[(4-ethoxyphenyl)amino]-2-oxoethyl]-4-oxo-2-thioxo-, methyl ester

SpectraBase Compound ID	DOAZfSNzWM0
InChI	InChI=1S/C22H22ClN3O5S/c1-3-31-17-10-6-15(7-11-17)24-19(27)12-18-21(29)26(16-8-4-14(23)5-9-16)22(32)25(18)13-20(28)30-2/h4-11,18H,3,12-13H2,1-2H3,(H,24,27)
InChIKey	MKQAWFGASISVNY-UHFFFAOYSA-N Google Search
Mol Weight	475.95 g/mol
Molecular Formula	C22H22ClN3O5S
Exact Mass	475.09687 g/mol

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SpectraBase Spectrum ID	CUAA54ZJGh5
Name	1-imidazolidineacetic acid, 3-(4-chlorophenyl)-5-[2-[(4-ethoxyphenyl)amino]-2-oxoethyl]-4-oxo-2-thioxo-, 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/C22H22ClN3O5S/c1-3-31-17-10-6-15(7-11-17)24-19(27)12-18-21(29)26(16-8-4-14(23)5-9-16)22(32)25(18)13-20(28)30-2/h4-11,18H,3,12-13H2,1-2H3,(H,24,27)
InChIKey	MKQAWFGASISVNY-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_5906
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/12219521