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4-quinolinecarboxamide, N-[2-(3,4-diethoxyphenyl)ethyl]-2-(2-thienyl)-

View entire compound with spectra: 2 NMR

4-quinolinecarboxamide, N-[2-(3,4-diethoxyphenyl)ethyl]-2-(2-thienyl)-
SpectraBase Compound ID 9hRAGNeibtj
InChI InChI=1S/C26H26N2O3S/c1-3-30-23-12-11-18(16-24(23)31-4-2)13-14-27-26(29)20-17-22(25-10-7-15-32-25)28-21-9-6-5-8-19(20)21/h5-12,15-17H,3-4,13-14H2,1-2H3,(H,27,29)
InChIKey KUUMZZKCAHFYHN-UHFFFAOYSA-N
Mol Weight 446.57 g/mol
Molecular Formula C26H26N2O3S
Exact Mass 446.166414 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L52xJe6pJu7
Name 4-Quinolinecarboxamide, N-[2-(3,4-diethoxyphenyl)ethyl]-2-(2-thienyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.166413876 u
Formula C26H26N2O3S
InChI InChI=1S/C26H26N2O3S/c1-3-30-23-12-11-18(16-24(23)31-4-2)13-14-27-26(29)20-17-22(25-10-7-15-32-25)28-21-9-6-5-8-19(20)21/h5-12,15-17H,3-4,13-14H2,1-2H3,(H,27,29)
InChIKey KUUMZZKCAHFYHN-UHFFFAOYSA-N
Molecular Weight 446.565 g/mol
SMILES N(C(C1=CC(C=2SC=CC2)=NC=2C1=CC=CC2)=O)CCC=1C=C(OCC)C(=CC1)OCC