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4-quinolinecarboxamide, 2-(5-chloro-2-thienyl)-N-[3-(3-methyl-1-piperidinyl)propyl]-
SpectraBase Compound ID 1k6u2X4aAzN
InChI InChI=1S/C23H26ClN3OS/c1-16-6-4-12-27(15-16)13-5-11-25-23(28)18-14-20(21-9-10-22(24)29-21)26-19-8-3-2-7-17(18)19/h2-3,7-10,14,16H,4-6,11-13,15H2,1H3,(H,25,28)
InChIKey ZROUVUQPTDRFQM-UHFFFAOYSA-N
Mol Weight 427.99 g/mol
Molecular Formula C23H26ClN3OS
Exact Mass 427.148511 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D9PDks40ugx
Name 4-Quinolinecarboxamide, 2-(5-chloro-2-thienyl)-N-[3-(3-methyl-1-piperidinyl)propyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 427.148511342 u
Formula C23H26ClN3OS
InChI InChI=1S/C23H26ClN3OS/c1-16-6-4-12-27(15-16)13-5-11-25-23(28)18-14-20(21-9-10-22(24)29-21)26-19-8-3-2-7-17(18)19/h2-3,7-10,14,16H,4-6,11-13,15H2,1H3,(H,25,28)
InChIKey ZROUVUQPTDRFQM-UHFFFAOYSA-N
Molecular Weight 427.994 g/mol
SMILES N(C(C1=CC(=NC2=CC=CC=C12)C=1SC(Cl)=CC1)=O)CCCN1CC(C)CCC1