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ethyl 4-{3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-4-[2-oxo-2-(4-propoxyanilino)ethyl]-2-thioxo-1-imidazolidinyl}benzoate
SpectraBase Compound ID 7aE6Z8tlSeL
InChI InChI=1S/C31H40N4O5S/c1-4-20-40-26-12-8-24(9-13-26)32-28(36)21-27-29(37)35(25-10-6-23(7-11-25)30(38)39-5-2)31(41)34(27)19-18-33-16-14-22(3)15-17-33/h6-13,22,27H,4-5,14-21H2,1-3H3,(H,32,36)
InChIKey ICEQUUQPRWNGNH-UHFFFAOYSA-N
Mol Weight 580.7 g/mol
Molecular Formula C31H40N4O5S
Exact Mass 580.271942 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IIllS8d6q0E
Name ethyl 4-{3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-4-[2-oxo-2-(4-propoxyanilino)ethyl]-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 580.271941573 u
Formula C31H40N4O5S
InChI InChI=1S/C31H40N4O5S/c1-4-20-40-26-12-8-24(9-13-26)32-28(36)21-27-29(37)35(25-10-6-23(7-11-25)30(38)39-5-2)31(41)34(27)19-18-33-16-14-22(3)15-17-33/h6-13,22,27H,4-5,14-21H2,1-3H3,(H,32,36)
InChIKey ICEQUUQPRWNGNH-UHFFFAOYSA-N
Molecular Weight 580.744 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2507
Solvent DMSO-d6
Source Vendor ID: NMR/12279549