benzoic acid, 4-[[[1-(4-ethoxyphenyl)-5-oxo-3-(phenylmethyl)-2-thioxo-4-imidazolidinyl]acetyl]amino]-, methyl ester

SpectraBase Compound ID	L29gjSWUI7H
InChI	InChI=1S/C28H27N3O5S/c1-3-36-23-15-13-22(14-16-23)31-26(33)24(30(28(31)37)18-19-7-5-4-6-8-19)17-25(32)29-21-11-9-20(10-12-21)27(34)35-2/h4-16,24H,3,17-18H2,1-2H3,(H,29,32)
InChIKey	VKQYBLDUFVWQFY-UHFFFAOYSA-N Google Search
Mol Weight	517.6 g/mol
Molecular Formula	C28H27N3O5S
Exact Mass	517.167142 g/mol

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SpectraBase Spectrum ID	CzliKnCd7p1
Name	benzoic acid, 4-[[[1-(4-ethoxyphenyl)-5-oxo-3-(phenylmethyl)-2-thioxo-4-imidazolidinyl]acetyl]amino]-, 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/C28H27N3O5S/c1-3-36-23-15-13-22(14-16-23)31-26(33)24(30(28(31)37)18-19-7-5-4-6-8-19)17-25(32)29-21-11-9-20(10-12-21)27(34)35-2/h4-16,24H,3,17-18H2,1-2H3,(H,29,32)
InChIKey	VKQYBLDUFVWQFY-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_3139
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/11278764