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4-imidazolidineacetamide, 1-(4-chlorophenyl)-N-(4-fluorophenyl)-5-oxo-3-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-2-thioxo-
SpectraBase Compound ID CVSsVBhU5gz
InChI InChI=1S/C31H33ClFN5O2S/c32-24-7-13-27(14-8-24)38-30(40)28(21-29(39)34-26-11-9-25(33)10-12-26)37(31(38)41)16-4-15-35-17-19-36(20-18-35)22-23-5-2-1-3-6-23/h1-3,5-14,28H,4,15-22H2,(H,34,39)
InChIKey SZYWYLIXTSSIGU-UHFFFAOYSA-N
Mol Weight 594.1 g/mol
Molecular Formula C31H33ClFN5O2S
Exact Mass 593.202752 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FUkdXmOfw0H
Name 4-imidazolidineacetamide, 1-(4-chlorophenyl)-N-(4-fluorophenyl)-5-oxo-3-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-2-thioxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 593.202752358 u
Formula C31H33ClFN5O2S
InChI InChI=1S/C31H33ClFN5O2S/c32-24-7-13-27(14-8-24)38-30(40)28(21-29(39)34-26-11-9-25(33)10-12-26)37(31(38)41)16-4-15-35-17-19-36(20-18-35)22-23-5-2-1-3-6-23/h1-3,5-14,28H,4,15-22H2,(H,34,39)
InChIKey SZYWYLIXTSSIGU-UHFFFAOYSA-N
Molecular Weight 594.149 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_471
Solvent DMSO-d6
Source Vendor ID: NMR/13238947