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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)acetamide
SpectraBase Compound ID 5jxQklXvoHy
InChI InChI=1S/C22H18N4O2S2/c23-18(27)12-29-22-25-19-15-6-2-4-8-17(15)30-20(19)21(28)26(22)10-9-13-11-24-16-7-3-1-5-14(13)16/h1-8,11,24H,9-10,12H2,(H2,23,27)
InChIKey ACPDLVZBSVIBEB-UHFFFAOYSA-N
Mol Weight 434.53 g/mol
Molecular Formula C22H18N4O2S2
Exact Mass 434.087118 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JvBRObnSv6d
Name 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 434.087118182 u
Formula C22H18N4O2S2
InChI InChI=1S/C22H18N4O2S2/c23-18(27)12-29-22-25-19-15-6-2-4-8-17(15)30-20(19)21(28)26(22)10-9-13-11-24-16-7-3-1-5-14(13)16/h1-8,11,24H,9-10,12H2,(H2,23,27)
InChIKey ACPDLVZBSVIBEB-UHFFFAOYSA-N
Molecular Weight 434.532 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7784
Solvent DMSO-d6
Source Vendor ID: NMR/13218528