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2-(2-chlorophenyl)-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

2-(2-chlorophenyl)-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-4-quinolinecarboxamide
SpectraBase Compound ID 40yBdDfbDyM
InChI InChI=1S/C24H16ClN3O3S2/c1-33(30,31)14-10-11-20-22(12-14)32-24(27-20)28-23(29)17-13-21(16-7-2-4-8-18(16)25)26-19-9-5-3-6-15(17)19/h2-13H,1H3,(H,27,28,29)
InChIKey MURRNJTXKMERAD-UHFFFAOYSA-N
Mol Weight 493.98 g/mol
Molecular Formula C24H16ClN3O3S2
Exact Mass 493.032161 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LsX0mdvEb6B
Name 2-(2-Chlorophenyl)-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 493.032161432 u
Formula C24H16ClN3O3S2
InChI InChI=1S/C24H16ClN3O3S2/c1-33(30,31)14-10-11-20-22(12-14)32-24(27-20)28-23(29)17-13-21(16-7-2-4-8-18(16)25)26-19-9-5-3-6-15(17)19/h2-13H,1H3,(H,27,28,29)
InChIKey MURRNJTXKMERAD-UHFFFAOYSA-N
Molecular Weight 493.983 g/mol
SMILES N(C=1SC=2C=C(S(=O)(=O)C)C=CC2N1)C(C1=CC(=NC2=CC=CC=C12)C1=C(Cl)C=CC=C1)=O