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2-(5-chloro-2-thienyl)-N-[2-(3,4-dihydro-2(1H)-isoquinolinyl)ethyl]-4-quinolinecarboxamide
SpectraBase Compound ID QjMDh4TkQS
InChI InChI=1S/C25H22ClN3OS/c26-24-10-9-23(31-24)22-15-20(19-7-3-4-8-21(19)28-22)25(30)27-12-14-29-13-11-17-5-1-2-6-18(17)16-29/h1-10,15H,11-14,16H2,(H,27,30)
InChIKey ZTSKAXBPQPFBIK-UHFFFAOYSA-N
Mol Weight 447.98 g/mol
Molecular Formula C25H22ClN3OS
Exact Mass 447.117211 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F6KUSpFwSHe
Name 2-(5-chloro-2-thienyl)-N-[2-(3,4-dihydro-2(1H)-isoquinolinyl)ethyl]-4-quinolinecarboxamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 447.117211213 u
Formula C25H22ClN3OS
InChI InChI=1S/C25H22ClN3OS/c26-24-10-9-23(31-24)22-15-20(19-7-3-4-8-21(19)28-22)25(30)27-12-14-29-13-11-17-5-1-2-6-18(17)16-29/h1-10,15H,11-14,16H2,(H,27,30)
InChIKey ZTSKAXBPQPFBIK-UHFFFAOYSA-N
Molecular Weight 447.984 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4444
Solvent DMSO-d6
Source Vendor ID: NMR/12309364