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N-cyclohexyl-2-{[3-(2-hydroxyethyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
SpectraBase Compound ID LCDwX40euYT
InChI InChI=1S/C20H23N3O3S2/c24-11-10-23-19(26)18-17(14-8-4-5-9-15(14)28-18)22-20(23)27-12-16(25)21-13-6-2-1-3-7-13/h4-5,8-9,13,24H,1-3,6-7,10-12H2,(H,21,25)
InChIKey RFFAIAXQXOQCOR-UHFFFAOYSA-N
Mol Weight 417.54 g/mol
Molecular Formula C20H23N3O3S2
Exact Mass 417.118084 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7Mb4h2Yr0xD
Name N-cyclohexyl-2-{[3-(2-hydroxyethyl)-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 417.118083958 u
Formula C20H23N3O3S2
InChI InChI=1S/C20H23N3O3S2/c24-11-10-23-19(26)18-17(14-8-4-5-9-15(14)28-18)22-20(23)27-12-16(25)21-13-6-2-1-3-7-13/h4-5,8-9,13,24H,1-3,6-7,10-12H2,(H,21,25)
InChIKey RFFAIAXQXOQCOR-UHFFFAOYSA-N
Molecular Weight 417.542 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7808
Solvent DMSO-d6
Source Vendor ID: NMR/13218555