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(2E)-2-cyano-N-(4-fluorophenyl)-2-[(5E)-5-(2-furylmethylene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
SpectraBase Compound ID GnyOWCpYwCy
InChI InChI=1S/C23H14FN3O3S/c24-15-8-10-16(11-9-15)26-21(28)19(14-25)23-27(17-5-2-1-3-6-17)22(29)20(31-23)13-18-7-4-12-30-18/h1-13H,(H,26,28)/b20-13+,23-19+
InChIKey PTPLTAFZGULQGF-NXLXSZEBSA-N
Mol Weight 431.44 g/mol
Molecular Formula C23H14FN3O3S
Exact Mass 431.073991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AmTtyaazVHV
Name (2E)-2-Cyano-N-(4-fluorophenyl)-2-[(5E)-5-(2-furylmethylene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 431.073990657 u
Formula C23H14FN3O3S
InChI InChI=1S/C23H14FN3O3S/c24-15-8-10-16(11-9-15)26-21(28)19(14-25)23-27(17-5-2-1-3-6-17)22(29)20(31-23)13-18-7-4-12-30-18/h1-13H,(H,26,28)/b20-13+,23-19+
InChIKey PTPLTAFZGULQGF-NXLXSZEBSA-N
Molecular Weight 431.441 g/mol
SMILES N(C(\C(=C/1N(C(=O)\C(S1)=C/C=1OC=CC1)C=1C=CC=CC1)C#N)=O)C1=CC=C(C=C1)F