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2-[(3-cyclohexyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
SpectraBase Compound ID BVWGAuY3UOX
InChI InChI=1S/C24H22FN3O2S2/c25-15-10-12-16(13-11-15)26-20(29)14-31-24-27-21-18-8-4-5-9-19(18)32-22(21)23(30)28(24)17-6-2-1-3-7-17/h4-5,8-13,17H,1-3,6-7,14H2,(H,26,29)
InChIKey HWJZUZPCPVWNCS-UHFFFAOYSA-N
Mol Weight 467.58 g/mol
Molecular Formula C24H22FN3O2S2
Exact Mass 467.113747 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3dInU0fKsjo
Name 2-[(3-cyclohexyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(4-fluorophenyl)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 467.113747469 u
Formula C24H22FN3O2S2
InChI InChI=1S/C24H22FN3O2S2/c25-15-10-12-16(13-11-15)26-20(29)14-31-24-27-21-18-8-4-5-9-19(18)32-22(21)23(30)28(24)17-6-2-1-3-7-17/h4-5,8-13,17H,1-3,6-7,14H2,(H,26,29)
InChIKey HWJZUZPCPVWNCS-UHFFFAOYSA-N
Molecular Weight 467.577 g/mol
NMR Offset 17.9985
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9844
Solvent DMSO-d6
Source Vendor ID: NMR/13229916