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benzoic acid, 4-[[[3-[(4-chlorophenyl)methyl]-1-(4-fluorophenyl)-5-oxo-2-thioxo-4-imidazolidinyl]acetyl]amino]-, methyl ester

View entire compound with spectra: 1 NMR

benzoic acid, 4-[[[3-[(4-chlorophenyl)methyl]-1-(4-fluorophenyl)-5-oxo-2-thioxo-4-imidazolidinyl]acetyl]amino]-, methyl ester
SpectraBase Compound ID 1rhCkIaMWgs
InChI InChI=1S/C26H21ClFN3O4S/c1-35-25(34)17-4-10-20(11-5-17)29-23(32)14-22-24(33)31(21-12-8-19(28)9-13-21)26(36)30(22)15-16-2-6-18(27)7-3-16/h2-13,22H,14-15H2,1H3,(H,29,32)
InChIKey BFLPGVCLNQTRIH-UHFFFAOYSA-N
Mol Weight 525.98 g/mol
Molecular Formula C26H21ClFN3O4S
Exact Mass 525.092533 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6gKVHS8jk1I
Name benzoic acid, 4-[[[3-[(4-chlorophenyl)methyl]-1-(4-fluorophenyl)-5-oxo-2-thioxo-4-imidazolidinyl]acetyl]amino]-, methyl ester
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/C26H21ClFN3O4S/c1-35-25(34)17-4-10-20(11-5-17)29-23(32)14-22-24(33)31(21-12-8-19(28)9-13-21)26(36)30(22)15-16-2-6-18(27)7-3-16/h2-13,22H,14-15H2,1H3,(H,29,32)
InChIKey BFLPGVCLNQTRIH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_3137
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/11278762