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ethyl ({3-[3-(4-morpholinyl)propyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate
SpectraBase Compound ID 6u037ZTII9q
InChI InChI=1S/C21H25N3O4S2/c1-2-28-17(25)14-29-21-22-18-15-6-3-4-7-16(15)30-19(18)20(26)24(21)9-5-8-23-10-12-27-13-11-23/h3-4,6-7H,2,5,8-14H2,1H3
InChIKey ZTZGHGIXEJYDBR-UHFFFAOYSA-N
Mol Weight 447.57 g/mol
Molecular Formula C21H25N3O4S2
Exact Mass 447.128649 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 892bwS9uhgb
Name ethyl ({3-[3-(4-morpholinyl)propyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 447.128648641 u
Formula C21H25N3O4S2
InChI InChI=1S/C21H25N3O4S2/c1-2-28-17(25)14-29-21-22-18-15-6-3-4-7-16(15)30-19(18)20(26)24(21)9-5-8-23-10-12-27-13-11-23/h3-4,6-7H,2,5,8-14H2,1H3
InChIKey ZTZGHGIXEJYDBR-UHFFFAOYSA-N
Molecular Weight 447.568 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7310
Solvent DMSO-d6
Source Vendor ID: NMR/13218051