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N-(4-fluorophenyl)-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 9iR3e4v2gcL
InChI InChI=1S/C28H21FN4O2S2/c29-18-9-11-19(12-10-18)31-24(34)16-36-28-32-25-21-6-2-4-8-23(21)37-26(25)27(35)33(28)14-13-17-15-30-22-7-3-1-5-20(17)22/h1-12,15,30H,13-14,16H2,(H,31,34)
InChIKey NCQSKTWJCJZVRW-UHFFFAOYSA-N
Mol Weight 528.62 g/mol
Molecular Formula C28H21FN4O2S2
Exact Mass 528.108996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7WlBfqsfUgy
Name N-(4-fluorophenyl)-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 528.108996441 u
Formula C28H21FN4O2S2
InChI InChI=1S/C28H21FN4O2S2/c29-18-9-11-19(12-10-18)31-24(34)16-36-28-32-25-21-6-2-4-8-23(21)37-26(25)27(35)33(28)14-13-17-15-30-22-7-3-1-5-20(17)22/h1-12,15,30H,13-14,16H2,(H,31,34)
InChIKey NCQSKTWJCJZVRW-UHFFFAOYSA-N
Molecular Weight 528.620 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7806
Solvent DMSO-d6
Source Vendor ID: NMR/13218552