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(5Z)-3-(3-chloro-4-fluorophenyl)-5-[(2E)-2-methyl-3-phenyl-2-propenylidene]-2-thioxo-1,3-thiazolidin-4-one
SpectraBase Compound ID 29dRfGY8k07
InChI InChI=1S/C19H13ClFNOS2/c1-12(9-13-5-3-2-4-6-13)10-17-18(23)22(19(24)25-17)14-7-8-16(21)15(20)11-14/h2-11H,1H3/b12-9+,17-10-
InChIKey CQEZPUNOPHLGEQ-YZXVBUGESA-N
Mol Weight 389.89 g/mol
Molecular Formula C19H13ClFNOS2
Exact Mass 389.011112 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5EHROpQbbWN
Name (5Z)-3-(3-Chloro-4-fluorophenyl)-5-[(2E)-2-methyl-3-phenyl-2-propenylidene]-2-thioxo-1,3-thiazolidin-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.011112253 u
Formula C19H13ClFNOS2
InChI InChI=1S/C19H13ClFNOS2/c1-12(9-13-5-3-2-4-6-13)10-17-18(23)22(19(24)25-17)14-7-8-16(21)15(20)11-14/h2-11H,1H3/b12-9+,17-10-
InChIKey CQEZPUNOPHLGEQ-YZXVBUGESA-N
Molecular Weight 389.890 g/mol
SMILES C=1C=CC(\C=C\(\C=C\2C(N(C(S2)=S)C=2C=C(Cl)C(=CC2)F)=O)C)=CC1