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2-[4-((E)-{2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)phenoxy]-N-(4-fluorophenyl)acetamide
SpectraBase Compound ID 5pFVZjMcYVX
InChI InChI=1S/C27H22FN3O5S/c1-17-2-8-20(9-3-17)29-24(32)15-31-26(34)23(37-27(31)35)14-18-4-12-22(13-5-18)36-16-25(33)30-21-10-6-19(28)7-11-21/h2-14H,15-16H2,1H3,(H,29,32)(H,30,33)/b23-14+
InChIKey HZWVFROHHUQLHF-OEAKJJBVSA-N
Mol Weight 519.55 g/mol
Molecular Formula C27H22FN3O5S
Exact Mass 519.12642 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G3OiU2FsfHO
Name 2-[4-((E)-{2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)phenoxy]-N-(4-fluorophenyl)acetamide
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/C27H22FN3O5S/c1-17-2-8-20(9-3-17)29-24(32)15-31-26(34)23(37-27(31)35)14-18-4-12-22(13-5-18)36-16-25(33)30-21-10-6-19(28)7-11-21/h2-14H,15-16H2,1H3,(H,29,32)(H,30,33)/b23-14+
InChIKey HZWVFROHHUQLHF-OEAKJJBVSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_2730
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: UZI/1007792; Labnumber: ARF3317; UZI_ID: UZI-002732
Synonyms 2-[4-({2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)phenoxy]-N-(4-fluorophenyl)acetamide
Temperature 318 °C