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4-imidazolidineacetamide, 3-[2-(acetylamino)ethyl]-1-(4-chlorophenyl)-N-(4-fluorophenyl)-5-oxo-2-thioxo-
SpectraBase Compound ID IsG69XIT06x
InChI InChI=1S/C21H20ClFN4O3S/c1-13(28)24-10-11-26-18(12-19(29)25-16-6-4-15(23)5-7-16)20(30)27(21(26)31)17-8-2-14(22)3-9-17/h2-9,18H,10-12H2,1H3,(H,24,28)(H,25,29)
InChIKey CFQLGXYSMDVBNF-UHFFFAOYSA-N
Mol Weight 462.93 g/mol
Molecular Formula C21H20ClFN4O3S
Exact Mass 462.092868 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID WTHDswp3Am
Name 4-imidazolidineacetamide, 3-[2-(acetylamino)ethyl]-1-(4-chlorophenyl)-N-(4-fluorophenyl)-5-oxo-2-thioxo-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H20ClFN4O3S/c1-13(28)24-10-11-26-18(12-19(29)25-16-6-4-15(23)5-7-16)20(30)27(21(26)31)17-8-2-14(22)3-9-17/h2-9,18H,10-12H2,1H3,(H,24,28)(H,25,29)
InChIKey CFQLGXYSMDVBNF-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6881
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/12228230