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3-[2-(1H-indol-3-yl)ethyl]-2-[(2-methylbenzyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 1mpSsq1iEgZ
InChI InChI=1S/C28H23N3OS2/c1-18-8-2-3-9-20(18)17-33-28-30-25-22-11-5-7-13-24(22)34-26(25)27(32)31(28)15-14-19-16-29-23-12-6-4-10-21(19)23/h2-13,16,29H,14-15,17H2,1H3
InChIKey UDIJYKGVXNUKPA-UHFFFAOYSA-N
Mol Weight 481.63 g/mol
Molecular Formula C28H23N3OS2
Exact Mass 481.128255 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DfqvS45AxlV
Name 3-[2-(1H-indol-3-yl)ethyl]-2-[(2-methylbenzyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 481.128254720 u
Formula C28H23N3OS2
InChI InChI=1S/C28H23N3OS2/c1-18-8-2-3-9-20(18)17-33-28-30-25-22-11-5-7-13-24(22)34-26(25)27(32)31(28)15-14-19-16-29-23-12-6-4-10-21(19)23/h2-13,16,29H,14-15,17H2,1H3
InChIKey UDIJYKGVXNUKPA-UHFFFAOYSA-N
Molecular Weight 481.632 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7816
Solvent DMSO-d6
Source Vendor ID: NMR/13218565