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(2E)-2-cyano-2-[(5E)-5-(3,4-dimethoxybenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(4-fluorophenyl)ethanamide
SpectraBase Compound ID 9JH7lCAedl3
InChI InChI=1S/C27H20FN3O4S/c1-34-22-13-8-17(14-23(22)35-2)15-24-26(33)31(20-6-4-3-5-7-20)27(36-24)21(16-29)25(32)30-19-11-9-18(28)10-12-19/h3-15H,1-2H3,(H,30,32)/b24-15+,27-21+
InChIKey RPPGRGJDZYKVSM-LWHAXBPHSA-N
Mol Weight 501.53 g/mol
Molecular Formula C27H20FN3O4S
Exact Mass 501.115855 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Bp50pGAGpTc
Name (2E)-2-cyano-2-[(5E)-5-(3,4-dimethoxybenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(4-fluorophenyl)ethanamide
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/C27H20FN3O4S/c1-34-22-13-8-17(14-23(22)35-2)15-24-26(33)31(20-6-4-3-5-7-20)27(36-24)21(16-29)25(32)30-19-11-9-18(28)10-12-19/h3-15H,1-2H3,(H,30,32)/b24-15+,27-21+
InChIKey RPPGRGJDZYKVSM-LWHAXBPHSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26724
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: D66569; Labnumber: EXP17Mat001044; SBI_ID: SBI-026728
Synonyms 2-cyano-2-[5-(3,4-dimethoxybenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(4-fluorophenyl)ethanamide
Temperature 318 °C