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2-[3-[3-(4-benzyl-1-piperazinyl)propyl]-1-(4-methoxyphenyl)-5-oxo-2-thioxo-4-imidazolidinyl]-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID 1Xe6cc46pEz
InChI InChI=1S/C33H39N5O4S/c1-41-28-13-9-26(10-14-28)34-31(39)23-30-32(40)38(27-11-15-29(42-2)16-12-27)33(43)37(30)18-6-17-35-19-21-36(22-20-35)24-25-7-4-3-5-8-25/h3-5,7-16,30H,6,17-24H2,1-2H3,(H,34,39)
InChIKey XJHRUPOIPFKVST-UHFFFAOYSA-N
Mol Weight 601.8 g/mol
Molecular Formula C33H39N5O4S
Exact Mass 601.272276 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CWutQx2Inlr
Name 2-[3-[3-(4-benzyl-1-piperazinyl)propyl]-1-(4-methoxyphenyl)-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 601.272275926 u
Formula C33H39N5O4S
InChI InChI=1S/C33H39N5O4S/c1-41-28-13-9-26(10-14-28)34-31(39)23-30-32(40)38(27-11-15-29(42-2)16-12-27)33(43)37(30)18-6-17-35-19-21-36(22-20-35)24-25-7-4-3-5-8-25/h3-5,7-16,30H,6,17-24H2,1-2H3,(H,34,39)
InChIKey XJHRUPOIPFKVST-UHFFFAOYSA-N
Molecular Weight 601.766 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8585
Solvent DMSO-d6
Source Vendor ID: NMR/13219869