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ethyl 4-{4-[2-(4-methoxyanilino)-2-oxoethyl]-3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-2-thioxo-1-imidazolidinyl}benzoate

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ethyl 4-{4-[2-(4-methoxyanilino)-2-oxoethyl]-3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-2-thioxo-1-imidazolidinyl}benzoate
SpectraBase Compound ID 8aHDJKSkk2o
InChI InChI=1S/C29H36N4O5S/c1-4-38-28(36)21-5-9-23(10-6-21)33-27(35)25(19-26(34)30-22-7-11-24(37-3)12-8-22)32(29(33)39)18-17-31-15-13-20(2)14-16-31/h5-12,20,25H,4,13-19H2,1-3H3,(H,30,34)
InChIKey FJAWSIBNLDKSRU-UHFFFAOYSA-N
Mol Weight 552.7 g/mol
Molecular Formula C29H36N4O5S
Exact Mass 552.240641 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ABBLDkeD02X
Name ethyl 4-{4-[2-(4-methoxyanilino)-2-oxoethyl]-3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-2-thioxo-1-imidazolidinyl}benzoate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 552.240641444 u
Formula C29H36N4O5S
InChI InChI=1S/C29H36N4O5S/c1-4-38-28(36)21-5-9-23(10-6-21)33-27(35)25(19-26(34)30-22-7-11-24(37-3)12-8-22)32(29(33)39)18-17-31-15-13-20(2)14-16-31/h5-12,20,25H,4,13-19H2,1-3H3,(H,30,34)
InChIKey FJAWSIBNLDKSRU-UHFFFAOYSA-N
Molecular Weight 552.690 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2462
Solvent DMSO-d6
Source Vendor ID: NMR/12279503