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3-quinolinecarboxamide, 1-cyclopropyl-7-(4-ethyl-1-piperazinyl)-6-fluoro-1,4-dihydro-N-(4-methyl-2-thiazolyl)-4-oxo-

View entire compound with spectra: 2 NMR

3-quinolinecarboxamide, 1-cyclopropyl-7-(4-ethyl-1-piperazinyl)-6-fluoro-1,4-dihydro-N-(4-methyl-2-thiazolyl)-4-oxo-
SpectraBase Compound ID 9CxoKCEMBgr
InChI InChI=1S/C23H26FN5O2S/c1-3-27-6-8-28(9-7-27)20-11-19-16(10-18(20)24)21(30)17(12-29(19)15-4-5-15)22(31)26-23-25-14(2)13-32-23/h10-13,15H,3-9H2,1-2H3,(H,25,26,31)
InChIKey GMAILHZFCQWYRF-UHFFFAOYSA-N
Mol Weight 455.55 g/mol
Molecular Formula C23H26FN5O2S
Exact Mass 455.179124 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 672UvdZxphP
Name 3-Quinolinecarboxamide, 1-cyclopropyl-7-(4-ethyl-1-piperazinyl)-6-fluoro-1,4-dihydro-N-(4-methyl-2-thiazolyl)-4-oxo-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 455.179124432 u
Formula C23H26FN5O2S
InChI InChI=1S/C23H26FN5O2S/c1-3-27-6-8-28(9-7-27)20-11-19-16(10-18(20)24)21(30)17(12-29(19)15-4-5-15)22(31)26-23-25-14(2)13-32-23/h10-13,15H,3-9H2,1-2H3,(H,25,26,31)
InChIKey GMAILHZFCQWYRF-UHFFFAOYSA-N
Molecular Weight 455.552 g/mol
SMILES N(C1=NC(C)=CS1)C(C=1C(C2=CC(F)=C(C=C2N(C1)C1CC1)N1CCN(CC1)CC)=O)=O