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

View entire compound with spectra: 1 NMR

benzoic acid, 4-[4-[2-[(4-methoxyphenyl)amino]-2-oxoethyl]-5-oxo-3-[3-(4-phenyl-1-piperazinyl)propyl]-2-thioxo-1-imidazolidinyl]-, ethyl ester
SpectraBase Compound ID KBtLtCda2H1
InChI InChI=1S/C34H39N5O5S/c1-3-44-33(42)25-10-14-28(15-11-25)39-32(41)30(24-31(40)35-26-12-16-29(43-2)17-13-26)38(34(39)45)19-7-18-36-20-22-37(23-21-36)27-8-5-4-6-9-27/h4-6,8-17,30H,3,7,18-24H2,1-2H3,(H,35,40)
InChIKey IZYQXVMJDPHOCN-UHFFFAOYSA-N
Mol Weight 629.8 g/mol
Molecular Formula C34H39N5O5S
Exact Mass 629.267191 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2CXDuanCB4A
Name benzoic acid, 4-[4-[2-[(4-methoxyphenyl)amino]-2-oxoethyl]-5-oxo-3-[3-(4-phenyl-1-piperazinyl)propyl]-2-thioxo-1-imidazolidinyl]-, 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 629.267190545 u
Formula C34H39N5O5S
InChI InChI=1S/C34H39N5O5S/c1-3-44-33(42)25-10-14-28(15-11-25)39-32(41)30(24-31(40)35-26-12-16-29(43-2)17-13-26)38(34(39)45)19-7-18-36-20-22-37(23-21-36)27-8-5-4-6-9-27/h4-6,8-17,30H,3,7,18-24H2,1-2H3,(H,35,40)
InChIKey IZYQXVMJDPHOCN-UHFFFAOYSA-N
Molecular Weight 629.776 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_477
Solvent DMSO-d6
Source Vendor ID: NMR/13238954