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N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-2-phenyl-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-2-phenyl-4-quinolinecarboxamide
SpectraBase Compound ID oe8rtswy86
InChI InChI=1S/C22H20N4O/c1-15-17(14-26(2)25-15)13-23-22(27)19-12-21(16-8-4-3-5-9-16)24-20-11-7-6-10-18(19)20/h3-12,14H,13H2,1-2H3,(H,23,27)
InChIKey WMCYRGYJVOSTFG-UHFFFAOYSA-N
Mol Weight 356.43 g/mol
Molecular Formula C22H20N4O
Exact Mass 356.163711 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ByOWddd7aFS
Name N-[(1,3-Dimethyl-1H-pyrazol-4-yl)methyl]-2-phenyl-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.163711279 u
Formula C22H20N4O
InChI InChI=1S/C22H20N4O/c1-15-17(14-26(2)25-15)13-23-22(27)19-12-21(16-8-4-3-5-9-16)24-20-11-7-6-10-18(19)20/h3-12,14H,13H2,1-2H3,(H,23,27)
InChIKey WMCYRGYJVOSTFG-UHFFFAOYSA-N
Molecular Weight 356.429 g/mol
SMILES N(CC=1C(=NN(C1)C)C)C(C1=CC(C2=CC=CC=C2)=NC=2C1=CC=CC2)=O