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3-amino-2-[(2-chloro-6-fluorobenzyl)sulfanyl]-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
SpectraBase Compound ID LsUZijYH7Ys
InChI InChI=1S/C23H20ClFN4O2S2/c1-11-7-8-17(12(2)9-11)27-20(30)19-13(3)18-21(33-19)28-23(29(26)22(18)31)32-10-14-15(24)5-4-6-16(14)25/h4-9H,10,26H2,1-3H3,(H,27,30)
InChIKey DOPDBHCMIHIBPT-UHFFFAOYSA-N
Mol Weight 503.01 g/mol
Molecular Formula C23H20ClFN4O2S2
Exact Mass 502.070024 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2RwooboxASf
Name 3-amino-2-[(2-chloro-6-fluorobenzyl)sulfanyl]-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 502.070024109 u
Formula C23H20ClFN4O2S2
InChI InChI=1S/C23H20ClFN4O2S2/c1-11-7-8-17(12(2)9-11)27-20(30)19-13(3)18-21(33-19)28-23(29(26)22(18)31)32-10-14-15(24)5-4-6-16(14)25/h4-9H,10,26H2,1-3H3,(H,27,30)
InChIKey DOPDBHCMIHIBPT-UHFFFAOYSA-N
Molecular Weight 503.010 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6658
Solvent DMSO-d6
Source Vendor ID: NMR/12328945