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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-methylbenzyl)acetamide

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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-methylbenzyl)acetamide
SpectraBase Compound ID J0eqB2olEog
InChI InChI=1S/C30H26N4O2S2/c1-19-10-12-20(13-11-19)16-32-26(35)18-37-30-33-27-23-7-3-5-9-25(23)38-28(27)29(36)34(30)15-14-21-17-31-24-8-4-2-6-22(21)24/h2-13,17,31H,14-16,18H2,1H3,(H,32,35)
InChIKey QNABPDTVOXKIIC-UHFFFAOYSA-N
Mol Weight 538.68 g/mol
Molecular Formula C30H26N4O2S2
Exact Mass 538.149718 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9l6i9oN19xs
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-methylbenzyl)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 538.149718439 u
Formula C30H26N4O2S2
InChI InChI=1S/C30H26N4O2S2/c1-19-10-12-20(13-11-19)16-32-26(35)18-37-30-33-27-23-7-3-5-9-25(23)38-28(27)29(36)34(30)15-14-21-17-31-24-8-4-2-6-22(21)24/h2-13,17,31H,14-16,18H2,1H3,(H,32,35)
InChIKey QNABPDTVOXKIIC-UHFFFAOYSA-N
Molecular Weight 538.684 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7797
Solvent DMSO-d6
Source Vendor ID: NMR/13218542