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4-imidazolidineacetamide, 1-(4-chlorophenyl)-3-[2-(4-methyl-1-piperazinyl)ethyl]-5-oxo-N-(4-propoxyphenyl)-2-thioxo-
SpectraBase Compound ID AN6imGhquSA
InChI InChI=1S/C27H34ClN5O3S/c1-3-18-36-23-10-6-21(7-11-23)29-25(34)19-24-26(35)33(22-8-4-20(28)5-9-22)27(37)32(24)17-16-31-14-12-30(2)13-15-31/h4-11,24H,3,12-19H2,1-2H3,(H,29,34)
InChIKey XMJMDOZACLFUKF-UHFFFAOYSA-N
Mol Weight 544.1 g/mol
Molecular Formula C27H34ClN5O3S
Exact Mass 543.207089 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6T7ZHcRI4Hh
Name 4-imidazolidineacetamide, 1-(4-chlorophenyl)-3-[2-(4-methyl-1-piperazinyl)ethyl]-5-oxo-N-(4-propoxyphenyl)-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 543.207088846 u
Formula C27H34ClN5O3S
InChI InChI=1S/C27H34ClN5O3S/c1-3-18-36-23-10-6-21(7-11-23)29-25(34)19-24-26(35)33(22-8-4-20(28)5-9-22)27(37)32(24)17-16-31-14-12-30(2)13-15-31/h4-11,24H,3,12-19H2,1-2H3,(H,29,34)
InChIKey XMJMDOZACLFUKF-UHFFFAOYSA-N
Molecular Weight 544.114 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_512
Solvent DMSO-d6
Source Vendor ID: NMR/13238996