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benzoic acid, 4-[4-[2-[[4-(ethoxycarbonyl)phenyl]amino]-2-oxoethyl]-5-oxo-3-[3-(4-phenyl-1-piperazinyl)propyl]-2-thioxo-1-imidazolidinyl]-

View entire compound with spectra: 1 NMR

benzoic acid, 4-[4-[2-[[4-(ethoxycarbonyl)phenyl]amino]-2-oxoethyl]-5-oxo-3-[3-(4-phenyl-1-piperazinyl)propyl]-2-thioxo-1-imidazolidinyl]-
SpectraBase Compound ID Efb6aMFRmu1
InChI InChI=1S/C36H41N5O6S/c1-3-46-34(44)26-11-15-28(16-12-26)37-32(42)25-31-33(43)41(30-17-13-27(14-18-30)35(45)47-4-2)36(48)40(31)20-8-19-38-21-23-39(24-22-38)29-9-6-5-7-10-29/h5-7,9-18,31H,3-4,8,19-25H2,1-2H3,(H,37,42)
InChIKey KCMYXYKDJZCGBJ-UHFFFAOYSA-N
Mol Weight 671.8 g/mol
Molecular Formula C36H41N5O6S
Exact Mass 671.277755 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8Nv2rwx7Iis
Name benzoic acid, 4-[4-[2-[[4-(ethoxycarbonyl)phenyl]amino]-2-oxoethyl]-5-oxo-3-[3-(4-phenyl-1-piperazinyl)propyl]-2-thioxo-1-imidazolidinyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 671.277755228 u
Formula C36H41N5O6S
InChI InChI=1S/C36H41N5O6S/c1-3-46-34(44)26-11-15-28(16-12-26)37-32(42)25-31-33(43)41(30-17-13-27(14-18-30)35(45)47-4-2)36(48)40(31)20-8-19-38-21-23-39(24-22-38)29-9-6-5-7-10-29/h5-7,9-18,31H,3-4,8,19-25H2,1-2H3,(H,37,42)
InChIKey KCMYXYKDJZCGBJ-UHFFFAOYSA-N
Molecular Weight 671.813 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_501
Solvent DMSO-d6
Source Vendor ID: NMR/13238982