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2-{[3-(3-isopropoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID 35dK71RLIHN
InChI InChI=1S/C25H27N3O4S2/c1-16(2)32-14-6-13-28-24(30)23-22(19-7-4-5-8-20(19)34-23)27-25(28)33-15-21(29)26-17-9-11-18(31-3)12-10-17/h4-5,7-12,16H,6,13-15H2,1-3H3,(H,26,29)
InChIKey DJCNISALCCZYSR-UHFFFAOYSA-N
Mol Weight 497.63 g/mol
Molecular Formula C25H27N3O4S2
Exact Mass 497.144299 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Csls2pQyEnV
Name 2-{[3-(3-isopropoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(4-methoxyphenyl)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 497.144298705 u
Formula C25H27N3O4S2
InChI InChI=1S/C25H27N3O4S2/c1-16(2)32-14-6-13-28-24(30)23-22(19-7-4-5-8-20(19)34-23)27-25(28)33-15-21(29)26-17-9-11-18(31-3)12-10-17/h4-5,7-12,16H,6,13-15H2,1-3H3,(H,26,29)
InChIKey DJCNISALCCZYSR-UHFFFAOYSA-N
Molecular Weight 497.628 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6243
Solvent DMSO-d6
Source Vendor ID: NMR/12328334