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4-pyridinecarboxamide, N-[(5Z)-5-[(4-hydroxyphenyl)methylene]-4-oxo-2-thioxothiazolidinyl]-
SpectraBase Compound ID UzUFboKvDs
InChI InChI=1S/C16H11N3O3S2/c20-12-3-1-10(2-4-12)9-13-15(22)19(16(23)24-13)18-14(21)11-5-7-17-8-6-11/h1-9,20H,(H,18,21)/b13-9-
InChIKey FELQHSPQNOADJS-LCYFTJDESA-N
Mol Weight 357.4 g/mol
Molecular Formula C16H11N3O3S2
Exact Mass 357.024184 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LeZriu7vRD7
Name 4-Pyridinecarboxamide, N-[(5Z)-5-[(4-hydroxyphenyl)methylene]-4-oxo-2-thioxothiazolidinyl]-
Comments Computed using HOSE algorithm
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Exact Mass 357.024183571 u
Formula C16H11N3O3S2
InChI InChI=1S/C16H11N3O3S2/c20-12-3-1-10(2-4-12)9-13-15(22)19(16(23)24-13)18-14(21)11-5-7-17-8-6-11/h1-9,20H,(H,18,21)/b13-9-
InChIKey FELQHSPQNOADJS-LCYFTJDESA-N
Molecular Weight 357.402 g/mol
SMILES N(N1C(\C(=C\C=2C=CC(=CC2)O)SC1=S)=O)C(=O)C=1C=CN=CC1