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(5E)-5-{4-[(3-chlorobenzyl)oxy]benzylidene}-2-imino-1,3-thiazolidin-4-one
SpectraBase Compound ID Ia9Ox4Upbc8
InChI InChI=1S/C17H13ClN2O2S/c18-13-3-1-2-12(8-13)10-22-14-6-4-11(5-7-14)9-15-16(21)20-17(19)23-15/h1-9H,10H2,(H2,19,20,21)/b15-9+
InChIKey INYUBKMKEYWDEA-OQLLNIDSSA-N
Mol Weight 344.82 g/mol
Molecular Formula C17H13ClN2O2S
Exact Mass 344.038627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6M170G6sjW0
Name (5E)-5-{4-[(3-Chlorobenzyl)oxy]benzylidene}-2-imino-1,3-thiazolidin-4-one
Comments Computed using HOSE algorithm
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Exact Mass 344.038626539 u
Formula C17H13ClN2O2S
InChI InChI=1S/C17H13ClN2O2S/c18-13-3-1-2-12(8-13)10-22-14-6-4-11(5-7-14)9-15-16(21)20-17(19)23-15/h1-9H,10H2,(H2,19,20,21)/b15-9+
InChIKey INYUBKMKEYWDEA-OQLLNIDSSA-N
Molecular Weight 344.816 g/mol
SMILES N1C(\C(SC1=N)=C/C1=CC=C(OCC=2C=C(Cl)C=CC2)C=C1)=O