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N-(4-fluorophenyl)-2-[(3-isopentyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
SpectraBase Compound ID akvWtA6OpK
InChI InChI=1S/C23H22FN3O2S2/c1-14(2)11-12-27-22(29)21-20(17-5-3-4-6-18(17)31-21)26-23(27)30-13-19(28)25-16-9-7-15(24)8-10-16/h3-10,14H,11-13H2,1-2H3,(H,25,28)
InChIKey UKAZFYFUVOXTIY-UHFFFAOYSA-N
Mol Weight 455.57 g/mol
Molecular Formula C23H22FN3O2S2
Exact Mass 455.113747 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DslsleGLm0z
Name N-(4-fluorophenyl)-2-[(3-isopentyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 455.113747469 u
Formula C23H22FN3O2S2
InChI InChI=1S/C23H22FN3O2S2/c1-14(2)11-12-27-22(29)21-20(17-5-3-4-6-18(17)31-21)26-23(27)30-13-19(28)25-16-9-7-15(24)8-10-16/h3-10,14H,11-13H2,1-2H3,(H,25,28)
InChIKey UKAZFYFUVOXTIY-UHFFFAOYSA-N
Molecular Weight 455.566 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6635
Solvent DMSO-d6
Source Vendor ID: NMR/12328911