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2-({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(4-isopropylphenyl)acetamide

View entire compound with spectra: 1 NMR

2-({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(4-isopropylphenyl)acetamide
SpectraBase Compound ID D1UfZopgwpx
InChI InChI=1S/C31H28N4O2S2/c1-19(2)20-11-13-22(14-12-20)33-27(36)18-38-31-34-28-24-8-4-6-10-26(24)39-29(28)30(37)35(31)16-15-21-17-32-25-9-5-3-7-23(21)25/h3-14,17,19,32H,15-16,18H2,1-2H3,(H,33,36)
InChIKey ITNXPOJTEHFPOD-UHFFFAOYSA-N
Mol Weight 552.71 g/mol
Molecular Formula C31H28N4O2S2
Exact Mass 552.165369 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LyPse1S4hE7
Name 2-({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(4-isopropylphenyl)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 552.165368504 u
Formula C31H28N4O2S2
InChI InChI=1S/C31H28N4O2S2/c1-19(2)20-11-13-22(14-12-20)33-27(36)18-38-31-34-28-24-8-4-6-10-26(24)39-29(28)30(37)35(31)16-15-21-17-32-25-9-5-3-7-23(21)25/h3-14,17,19,32H,15-16,18H2,1-2H3,(H,33,36)
InChIKey ITNXPOJTEHFPOD-UHFFFAOYSA-N
Molecular Weight 552.711 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7795
Solvent DMSO-d6
Source Vendor ID: NMR/13218540