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N-[2-(1-cyclohexen-1-yl)ethyl]-2-[(3-isopentyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
SpectraBase Compound ID 9QzeXlszT3i
InChI InChI=1S/C25H31N3O2S2/c1-17(2)13-15-28-24(30)23-22(19-10-6-7-11-20(19)32-23)27-25(28)31-16-21(29)26-14-12-18-8-4-3-5-9-18/h6-8,10-11,17H,3-5,9,12-16H2,1-2H3,(H,26,29)
InChIKey JNAKDLQGKBREAT-UHFFFAOYSA-N
Mol Weight 469.66 g/mol
Molecular Formula C25H31N3O2S2
Exact Mass 469.18577 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ccf9bE8Yd5D
Name N-[2-(1-cyclohexen-1-yl)ethyl]-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 469.185769596 u
Formula C25H31N3O2S2
InChI InChI=1S/C25H31N3O2S2/c1-17(2)13-15-28-24(30)23-22(19-10-6-7-11-20(19)32-23)27-25(28)31-16-21(29)26-14-12-18-8-4-3-5-9-18/h6-8,10-11,17H,3-5,9,12-16H2,1-2H3,(H,26,29)
InChIKey JNAKDLQGKBREAT-UHFFFAOYSA-N
Molecular Weight 469.662 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6638
Solvent DMSO-d6
Source Vendor ID: NMR/12328914