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2-(5-chloro-2-thienyl)-N-[2-(4-methoxyphenyl)ethyl]-4-quinolinecarboxamide

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2-(5-chloro-2-thienyl)-N-[2-(4-methoxyphenyl)ethyl]-4-quinolinecarboxamide
SpectraBase Compound ID 1e4o9XIAoHL
InChI InChI=1S/C23H19ClN2O2S/c1-28-16-8-6-15(7-9-16)12-13-25-23(27)18-14-20(21-10-11-22(24)29-21)26-19-5-3-2-4-17(18)19/h2-11,14H,12-13H2,1H3,(H,25,27)
InChIKey ZPQSVEDGAJQGAI-UHFFFAOYSA-N
Mol Weight 422.93 g/mol
Molecular Formula C23H19ClN2O2S
Exact Mass 422.085577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GeM74VGjOXD
Name 2-(5-Chloro-2-thienyl)-N-[2-(4-methoxyphenyl)ethyl]-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.085576732 u
Formula C23H19ClN2O2S
InChI InChI=1S/C23H19ClN2O2S/c1-28-16-8-6-15(7-9-16)12-13-25-23(27)18-14-20(21-10-11-22(24)29-21)26-19-5-3-2-4-17(18)19/h2-11,14H,12-13H2,1H3,(H,25,27)
InChIKey ZPQSVEDGAJQGAI-UHFFFAOYSA-N
Molecular Weight 422.930 g/mol
SMILES N(C(C=1C=C(N=C2C=CC=CC12)C=1SC(Cl)=CC1)=O)CCC1=CC=C(OC)C=C1