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N-[(E)-1-[(4-acetylanilino)carbonyl]-2-(2-thienyl)ethenyl]-2-furamide

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N-[(E)-1-[(4-acetylanilino)carbonyl]-2-(2-thienyl)ethenyl]-2-furamide
SpectraBase Compound ID EXHTW3ksRU3
InChI InChI=1S/C20H16N2O4S/c1-13(23)14-6-8-15(9-7-14)21-19(24)17(12-16-4-3-11-27-16)22-20(25)18-5-2-10-26-18/h2-12H,1H3,(H,21,24)(H,22,25)/b17-12+
InChIKey PZMVYWYMKPXSSV-SFQUDFHCSA-N
Mol Weight 380.42 g/mol
Molecular Formula C20H16N2O4S
Exact Mass 380.083078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FVYDz2MSbOh
Name N-[(E)-1-[(4-Acetylanilino)carbonyl]-2-(2-thienyl)ethenyl]-2-furamide
Comments Computed using HOSE algorithm
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Exact Mass 380.083078173 u
Formula C20H16N2O4S
InChI InChI=1S/C20H16N2O4S/c1-13(23)14-6-8-15(9-7-14)21-19(24)17(12-16-4-3-11-27-16)22-20(25)18-5-2-10-26-18/h2-12H,1H3,(H,21,24)(H,22,25)/b17-12+
InChIKey PZMVYWYMKPXSSV-SFQUDFHCSA-N
Molecular Weight 380.418 g/mol
SMILES N(C(\C(=C/C=1SC=CC1)NC(C=1OC=CC1)=O)=O)C=1C=CC(C(=O)C)=CC1