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2-[(3-butyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(2-furylmethyl)acetamide
SpectraBase Compound ID 60HdxL3y6y6
InChI InChI=1S/C21H21N3O3S2/c1-2-3-10-24-20(26)19-18(15-8-4-5-9-16(15)29-19)23-21(24)28-13-17(25)22-12-14-7-6-11-27-14/h4-9,11H,2-3,10,12-13H2,1H3,(H,22,25)
InChIKey SERLBIBZSIBPHC-UHFFFAOYSA-N
Mol Weight 427.54 g/mol
Molecular Formula C21H21N3O3S2
Exact Mass 427.102434 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Jg5A0NMhdId
Name 2-[(3-butyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(2-furylmethyl)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 427.102433893 u
Formula C21H21N3O3S2
InChI InChI=1S/C21H21N3O3S2/c1-2-3-10-24-20(26)19-18(15-8-4-5-9-16(15)29-19)23-21(24)28-13-17(25)22-12-14-7-6-11-27-14/h4-9,11H,2-3,10,12-13H2,1H3,(H,22,25)
InChIKey SERLBIBZSIBPHC-UHFFFAOYSA-N
Molecular Weight 427.537 g/mol
NMR Offset 17.9977
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9831
Solvent DMSO-d6
Source Vendor ID: NMR/13229903