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2-[(3-butyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
SpectraBase Compound ID 3WdVb8Nzek8
InChI InChI=1S/C24H25N3O2S2/c1-3-5-14-27-23(29)22-21(18-8-6-7-9-19(18)31-22)26-24(27)30-15-20(28)25-17-12-10-16(4-2)11-13-17/h6-13H,3-5,14-15H2,1-2H3,(H,25,28)
InChIKey CBXQABNZOUAAJD-UHFFFAOYSA-N
Mol Weight 451.6 g/mol
Molecular Formula C24H25N3O2S2
Exact Mass 451.138819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IXArCJf0BPD
Name 2-[(3-butyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(4-ethylphenyl)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 451.138819403 u
Formula C24H25N3O2S2
InChI InChI=1S/C24H25N3O2S2/c1-3-5-14-27-23(29)22-21(18-8-6-7-9-19(18)31-22)26-24(27)30-15-20(28)25-17-12-10-16(4-2)11-13-17/h6-13H,3-5,14-15H2,1-2H3,(H,25,28)
InChIKey CBXQABNZOUAAJD-UHFFFAOYSA-N
Molecular Weight 451.603 g/mol
NMR Offset 18.0005
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9837
Solvent DMSO-d6
Source Vendor ID: NMR/13229909