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3-cyclohexyl-2-[(2-oxo-2-phenylethyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
SpectraBase Compound ID JkY4hK5h3pX
InChI InChI=1S/C24H22N2O2S2/c27-19(16-9-3-1-4-10-16)15-29-24-25-21-18-13-7-8-14-20(18)30-22(21)23(28)26(24)17-11-5-2-6-12-17/h1,3-4,7-10,13-14,17H,2,5-6,11-12,15H2
InChIKey LTVKFESWMGPFJW-UHFFFAOYSA-N
Mol Weight 434.57 g/mol
Molecular Formula C24H22N2O2S2
Exact Mass 434.11227 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Hk49q6FMoCJ
Name 3-cyclohexyl-2-[(2-oxo-2-phenylethyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.112270302 u
Formula C24H22N2O2S2
InChI InChI=1S/C24H22N2O2S2/c27-19(16-9-3-1-4-10-16)15-29-24-25-21-18-13-7-8-14-20(18)30-22(21)23(28)26(24)17-11-5-2-6-12-17/h1,3-4,7-10,13-14,17H,2,5-6,11-12,15H2
InChIKey LTVKFESWMGPFJW-UHFFFAOYSA-N
Molecular Weight 434.572 g/mol
NMR Offset 17.9991
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9850
Solvent DMSO-d6
Source Vendor ID: NMR/13229923