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4-quinolinecarboxamide, N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(4-pyridinyl)-

View entire compound with spectra: 2 NMR

4-quinolinecarboxamide, N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(4-pyridinyl)-
SpectraBase Compound ID 3Y09NplV5XB
InChI InChI=1S/C18H13N5OS/c1-11-22-23-18(25-11)21-17(24)14-10-16(12-6-8-19-9-7-12)20-15-5-3-2-4-13(14)15/h2-10H,1H3,(H,21,23,24)
InChIKey ZSKOPRQMMZFBNN-UHFFFAOYSA-N
Mol Weight 347.4 g/mol
Molecular Formula C18H13N5OS
Exact Mass 347.084081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LKufrWLbFXg
Name 4-Quinolinecarboxamide, N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(4-pyridinyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 347.084081232 u
Formula C18H13N5OS
InChI InChI=1S/C18H13N5OS/c1-11-22-23-18(25-11)21-17(24)14-10-16(12-6-8-19-9-7-12)20-15-5-3-2-4-13(14)15/h2-10H,1H3,(H,21,23,24)
InChIKey ZSKOPRQMMZFBNN-UHFFFAOYSA-N
SMILES N(C=1SC(C)=NN1)C(C1=CC(C=2C=CN=CC2)=NC=2C1=CC=CC2)=O