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2-(1-(4-ethoxyphenyl)-3-{3-[4-(4-fluorophenyl)-1-piperazinyl]propyl}-5-oxo-2-thioxo-4-imidazolidinyl)-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID ALKk9Le8Krk
InChI InChI=1S/C33H38FN5O4S/c1-3-43-29-15-11-27(12-16-29)39-32(41)30(23-31(40)35-25-7-13-28(42-2)14-8-25)38(33(39)44)18-4-17-36-19-21-37(22-20-36)26-9-5-24(34)6-10-26/h5-16,30H,3-4,17-23H2,1-2H3,(H,35,40)
InChIKey FXCOYNPGUZPEOI-UHFFFAOYSA-N
Mol Weight 619.8 g/mol
Molecular Formula C33H38FN5O4S
Exact Mass 619.262854 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 36qKUH1NHQl
Name 2-(1-(4-ethoxyphenyl)-3-{3-[4-(4-fluorophenyl)-1-piperazinyl]propyl}-5-oxo-2-thioxo-4-imidazolidinyl)-N-(4-methoxyphenyl)acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 619.262854057 u
Formula C33H38FN5O4S
InChI InChI=1S/C33H38FN5O4S/c1-3-43-29-15-11-27(12-16-29)39-32(41)30(23-31(40)35-25-7-13-28(42-2)14-8-25)38(33(39)44)18-4-17-36-19-21-37(22-20-36)26-9-5-24(34)6-10-26/h5-16,30H,3-4,17-23H2,1-2H3,(H,35,40)
InChIKey FXCOYNPGUZPEOI-UHFFFAOYSA-N
Molecular Weight 619.756 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8597
Solvent DMSO-d6
Source Vendor ID: NMR/13219881