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N-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]-2-(8-quinolinylthio)acetamide
SpectraBase Compound ID KGmboVWkMIA
InChI InChI=1S/C23H21N5O3S2/c1-15-13-16(2)26-23(25-15)28-33(30,31)19-10-8-18(9-11-19)27-21(29)14-32-20-7-3-5-17-6-4-12-24-22(17)20/h3-13H,14H2,1-2H3,(H,27,29)(H,25,26,28)
InChIKey MXXXUJAHNCDRKF-UHFFFAOYSA-N
Mol Weight 479.57 g/mol
Molecular Formula C23H21N5O3S2
Exact Mass 479.108582 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5lcuNhgl6m6
Name acetamide, N-[4-[[(4,6-dimethyl-2-pyrimidinyl)amino]sulfonyl]phenyl]-2-(8-quinolinylthio)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 479.108581901 u
Formula C23H21N5O3S2
InChI InChI=1S/C23H21N5O3S2/c1-15-13-16(2)26-23(25-15)28-33(30,31)19-10-8-18(9-11-19)27-21(29)14-32-20-7-3-5-17-6-4-12-24-22(17)20/h3-13H,14H2,1-2H3,(H,27,29)(H,25,26,28)
InChIKey MXXXUJAHNCDRKF-UHFFFAOYSA-N
Molecular Weight 479.573 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11447
Solvent DMSO-d6
Source Vendor ID: NMR/10261436; Lab Info: NKS; Lab Number: NKS-ACA0281