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4-({3-[(4-ethoxyanilino)carbonyl]-4-methyl-5-phenyl-2-thienyl}amino)-4-oxobutanoic acid
SpectraBase Compound ID LBGjPIJTdcT
InChI InChI=1S/C24H24N2O5S/c1-3-31-18-11-9-17(10-12-18)25-23(30)21-15(2)22(16-7-5-4-6-8-16)32-24(21)26-19(27)13-14-20(28)29/h4-12H,3,13-14H2,1-2H3,(H,25,30)(H,26,27)(H,28,29)
InChIKey NDBQIWXQZIYWIH-UHFFFAOYSA-N
Mol Weight 452.53 g/mol
Molecular Formula C24H24N2O5S
Exact Mass 452.140593 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BOdpXjkX2UK
Name 4-({3-[(4-ethoxyanilino)carbonyl]-4-methyl-5-phenyl-2-thienyl}amino)-4-oxobutanoic acid
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/C24H24N2O5S/c1-3-31-18-11-9-17(10-12-18)25-23(30)21-15(2)22(16-7-5-4-6-8-16)32-24(21)26-19(27)13-14-20(28)29/h4-12H,3,13-14H2,1-2H3,(H,25,30)(H,26,27)(H,28,29)
InChIKey NDBQIWXQZIYWIH-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_687
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: ZI/8145715; Labnumber: DEC-1500017
Temperature 303 °C