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2-[(3-chlorobenzyl)sulfanyl]-3-[3-(1-pyrrolidinyl)propyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 4vEwPNPB7sH
InChI InChI=1S/C24H24ClN3OS2/c25-18-8-5-7-17(15-18)16-30-24-26-21-19-9-1-2-10-20(19)31-22(21)23(29)28(24)14-6-13-27-11-3-4-12-27/h1-2,5,7-10,15H,3-4,6,11-14,16H2
InChIKey FSORBHVDYSEPLW-UHFFFAOYSA-N
Mol Weight 470.05 g/mol
Molecular Formula C24H24ClN3OS2
Exact Mass 469.104932 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GWqlZCPCYmr
Name 2-[(3-chlorobenzyl)sulfanyl]-3-[3-(1-pyrrolidinyl)propyl][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 469.104932452 u
Formula C24H24ClN3OS2
InChI InChI=1S/C24H24ClN3OS2/c25-18-8-5-7-17(15-18)16-30-24-26-21-19-9-1-2-10-20(19)31-22(21)23(29)28(24)14-6-13-27-11-3-4-12-27/h1-2,5,7-10,15H,3-4,6,11-14,16H2
InChIKey FSORBHVDYSEPLW-UHFFFAOYSA-N
Molecular Weight 470.049 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6646
Solvent DMSO-d6
Source Vendor ID: NMR/12328926