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methyl 4-({[1-(4-methoxyphenyl)-5-oxo-3-(2-phenylethyl)-2-thioxo-4-imidazolidinyl]acetyl}amino)benzoate
SpectraBase Compound ID L5QhwwSHbc5
InChI InChI=1S/C28H27N3O5S/c1-35-23-14-12-22(13-15-23)31-26(33)24(30(28(31)37)17-16-19-6-4-3-5-7-19)18-25(32)29-21-10-8-20(9-11-21)27(34)36-2/h3-15,24H,16-18H2,1-2H3,(H,29,32)
InChIKey XLHCMRPRTSCVHR-UHFFFAOYSA-N
Mol Weight 517.6 g/mol
Molecular Formula C28H27N3O5S
Exact Mass 517.167142 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I1jodSx1Ny6
Name methyl 4-({[1-(4-methoxyphenyl)-5-oxo-3-(2-phenylethyl)-2-thioxo-4-imidazolidinyl]acetyl}amino)benzoate
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/c1-35-23-14-12-22(13-15-23)31-26(33)24(30(28(31)37)17-16-19-6-4-3-5-7-19)18-25(32)29-21-10-8-20(9-11-21)27(34)36-2/h3-15,24H,16-18H2,1-2H3,(H,29,32)
InChIKey XLHCMRPRTSCVHR-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18780
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: D11691; Labnumber: MPOL-09545; SBI_ID: SBI-018783
Temperature 306 °C