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2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methyl-1-piperazinyl)ethyl]-5-oxo-2-thioxo-4-imidazolidinyl}-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID HvasCKQ98mF
InChI InChI=1S/C26H32ClN5O4S/c1-29-10-12-30(13-11-29)14-15-31-22(17-24(33)28-18-4-7-20(35-2)8-5-18)25(34)32(26(31)37)19-6-9-23(36-3)21(27)16-19/h4-9,16,22H,10-15,17H2,1-3H3,(H,28,33)
InChIKey AGBIGMMGRQFKFQ-UHFFFAOYSA-N
Mol Weight 546.1 g/mol
Molecular Formula C26H32ClN5O4S
Exact Mass 545.186353 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6yTEkVQVcCF
Name 2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methyl-1-piperazinyl)ethyl]-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 545.186353400 u
Formula C26H32ClN5O4S
InChI InChI=1S/C26H32ClN5O4S/c1-29-10-12-30(13-11-29)14-15-31-22(17-24(33)28-18-4-7-20(35-2)8-5-18)25(34)32(26(31)37)19-6-9-23(36-3)21(27)16-19/h4-9,16,22H,10-15,17H2,1-3H3,(H,28,33)
InChIKey AGBIGMMGRQFKFQ-UHFFFAOYSA-N
Molecular Weight 546.086 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2488
Solvent DMSO-d6
Source Vendor ID: NMR/12279530