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N-benzyl-2-({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide
SpectraBase Compound ID LajUmTnScFg
InChI InChI=1S/C29H24N4O2S2/c34-25(31-16-19-8-2-1-3-9-19)18-36-29-32-26-22-11-5-7-13-24(22)37-27(26)28(35)33(29)15-14-20-17-30-23-12-6-4-10-21(20)23/h1-13,17,30H,14-16,18H2,(H,31,34)
InChIKey PKLXTOCNMIXPQY-UHFFFAOYSA-N
Mol Weight 524.66 g/mol
Molecular Formula C29H24N4O2S2
Exact Mass 524.134068 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1e14nHC1VxG
Name N-benzyl-2-({3-[2-(1H-indol-3-yl)ethyl]-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 524.134068375 u
Formula C29H24N4O2S2
InChI InChI=1S/C29H24N4O2S2/c34-25(31-16-19-8-2-1-3-9-19)18-36-29-32-26-22-11-5-7-13-24(22)37-27(26)28(35)33(29)15-14-20-17-30-23-12-6-4-10-21(20)23/h1-13,17,30H,14-16,18H2,(H,31,34)
InChIKey PKLXTOCNMIXPQY-UHFFFAOYSA-N
Molecular Weight 524.657 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7789
Solvent DMSO-d6
Source Vendor ID: NMR/13218534