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ethyl 4-{4-[2-(4-ethoxyanilino)-2-oxoethyl]-3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-2-thioxo-1-imidazolidinyl}benzoate
SpectraBase Compound ID BwgIsvzICTN
InChI InChI=1S/C30H38N4O5S/c1-4-38-25-12-8-23(9-13-25)31-27(35)20-26-28(36)34(24-10-6-22(7-11-24)29(37)39-5-2)30(40)33(26)19-18-32-16-14-21(3)15-17-32/h6-13,21,26H,4-5,14-20H2,1-3H3,(H,31,35)
InChIKey LDFWOBRNBDTZAS-UHFFFAOYSA-N
Mol Weight 566.7 g/mol
Molecular Formula C30H38N4O5S
Exact Mass 566.256292 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 67275swuzf6
Name ethyl 4-{4-[2-(4-ethoxyanilino)-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 566.256291509 u
Formula C30H38N4O5S
InChI InChI=1S/C30H38N4O5S/c1-4-38-25-12-8-23(9-13-25)31-27(35)20-26-28(36)34(24-10-6-22(7-11-24)29(37)39-5-2)30(40)33(26)19-18-32-16-14-21(3)15-17-32/h6-13,21,26H,4-5,14-20H2,1-3H3,(H,31,35)
InChIKey LDFWOBRNBDTZAS-UHFFFAOYSA-N
Molecular Weight 566.717 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2464
Solvent DMSO-d6
Source Vendor ID: NMR/12279505