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(2E)-2-[(5E)-5-(3-bromobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(4-fluorophenyl)ethanamide
SpectraBase Compound ID 52JCJUCgRm1
InChI InChI=1S/C25H15BrFN3O2S/c26-17-6-4-5-16(13-17)14-22-24(32)30(20-7-2-1-3-8-20)25(33-22)21(15-28)23(31)29-19-11-9-18(27)10-12-19/h1-14H,(H,29,31)/b22-14+,25-21+
InChIKey LUPHKYFJTBHGNO-BSKLEVBYSA-N
Mol Weight 520.38 g/mol
Molecular Formula C25H15BrFN3O2S
Exact Mass 519.005239 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DiIsZ25hEnB
Name (2E)-2-[(5E)-5-(3-bromobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-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/C25H15BrFN3O2S/c26-17-6-4-5-16(13-17)14-22-24(32)30(20-7-2-1-3-8-20)25(33-22)21(15-28)23(31)29-19-11-9-18(27)10-12-19/h1-14H,(H,29,31)/b22-14+,25-21+
InChIKey LUPHKYFJTBHGNO-BSKLEVBYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26732
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: D66584; Labnumber: EXP17Mat001063; SBI_ID: SBI-026736
Synonyms 2-[5-(3-bromobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(4-fluorophenyl)ethanamide
Temperature 318 °C