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(6Z)-5-imino-6-({1-[3-(3-methoxyphenoxy)propyl]-1H-indol-3-yl}methylene)-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID 2WPUl4exnOX
InChI InChI=1S/C25H22N4O3S/c1-31-18-6-4-7-19(15-18)32-12-5-10-28-16-17(20-8-2-3-9-22(20)28)14-21-23(26)29-11-13-33-25(29)27-24(21)30/h2-4,6-9,11,13-16,26H,5,10,12H2,1H3/b21-14-,26-23?
InChIKey ISIQKTOLQRBOEC-RNJGGXIZSA-N
Mol Weight 458.54 g/mol
Molecular Formula C25H22N4O3S
Exact Mass 458.141262 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DWmRe9P664h
Name (6Z)-5-imino-6-({1-[3-(3-methoxyphenoxy)propyl]-1H-indol-3-yl}methylene)-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-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 458.141261755 u
Formula C25H22N4O3S
InChI InChI=1S/C25H22N4O3S/c1-31-18-6-4-7-19(15-18)32-12-5-10-28-16-17(20-8-2-3-9-22(20)28)14-21-23(26)29-11-13-33-25(29)27-24(21)30/h2-4,6-9,11,13-16,26H,5,10,12H2,1H3/b21-14-,26-23?
InChIKey ISIQKTOLQRBOEC-RNJGGXIZSA-N
Molecular Weight 458.536 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_45
Solvent DMSO-d6
Source Vendor ID: NMR/12259697