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

View entire compound with spectra: 1 NMR

benzoic acid, 4-[[[1-(4-ethoxyphenyl)-5-oxo-3-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-2-thioxo-4-imidazolidinyl]acetyl]amino]-, ethyl ester
SpectraBase Compound ID Ed5XTPSkBV8
InChI InChI=1S/C36H43N5O5S/c1-3-45-31-17-15-30(16-18-31)41-34(43)32(25-33(42)37-29-13-11-28(12-14-29)35(44)46-4-2)40(36(41)47)20-8-19-38-21-23-39(24-22-38)26-27-9-6-5-7-10-27/h5-7,9-18,32H,3-4,8,19-26H2,1-2H3,(H,37,42)
InChIKey JCYLJGYAJNFQNJ-UHFFFAOYSA-N
Mol Weight 657.8 g/mol
Molecular Formula C36H43N5O5S
Exact Mass 657.298491 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AI9WTAyEVta
Name benzoic acid, 4-[[[1-(4-ethoxyphenyl)-5-oxo-3-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-2-thioxo-4-imidazolidinyl]acetyl]amino]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 657.298490674 u
Formula C36H43N5O5S
InChI InChI=1S/C36H43N5O5S/c1-3-45-31-17-15-30(16-18-31)41-34(43)32(25-33(42)37-29-13-11-28(12-14-29)35(44)46-4-2)40(36(41)47)20-8-19-38-21-23-39(24-22-38)26-27-9-6-5-7-10-27/h5-7,9-18,32H,3-4,8,19-26H2,1-2H3,(H,37,42)
InChIKey JCYLJGYAJNFQNJ-UHFFFAOYSA-N
Molecular Weight 657.830 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_462
Solvent DMSO-d6
Source Vendor ID: NMR/13238936