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2-((5E)-5-{4-[(3-fluorobenzyl)oxy]-3-methoxybenzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)-N-(4-methylphenyl)acetamide
SpectraBase Compound ID 65nUEt3Binp
InChI InChI=1S/C27H23FN2O5S/c1-17-6-9-21(10-7-17)29-25(31)15-30-26(32)24(36-27(30)33)14-18-8-11-22(23(13-18)34-2)35-16-19-4-3-5-20(28)12-19/h3-14H,15-16H2,1-2H3,(H,29,31)/b24-14+
InChIKey PIDPTBDCEVZCNL-ZVHZXABRSA-N
Mol Weight 506.55 g/mol
Molecular Formula C27H23FN2O5S
Exact Mass 506.131171 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6qJooXZV7iF
Name 2-((5E)-5-{4-[(3-Fluorobenzyl)oxy]-3-methoxybenzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)-N-(4-methylphenyl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 506.131171181 u
Formula C27H23FN2O5S
InChI InChI=1S/C27H23FN2O5S/c1-17-6-9-21(10-7-17)29-25(31)15-30-26(32)24(36-27(30)33)14-18-8-11-22(23(13-18)34-2)35-16-19-4-3-5-20(28)12-19/h3-14H,15-16H2,1-2H3,(H,29,31)/b24-14+
InChIKey PIDPTBDCEVZCNL-ZVHZXABRSA-N
Molecular Weight 506.548 g/mol
SMILES N(C(CN1C(S\C(C1=O)=C/C=1C=C(OC)C(=CC1)OCC=1C=C(F)C=CC1)=O)=O)C1=CC=C(C=C1)C