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(6Z)-5-imino-6-({1-[3-(2-methylphenoxy)propyl]-1H-indol-3-yl}methylene)-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID 1oPkqRPQ3bm
InChI InChI=1S/C25H22N4O2S/c1-17-7-2-5-10-22(17)31-13-6-11-28-16-18(19-8-3-4-9-21(19)28)15-20-23(26)29-12-14-32-25(29)27-24(20)30/h2-5,7-10,12,14-16,26H,6,11,13H2,1H3/b20-15-,26-23?
InChIKey CLPJCSFQKGMRPJ-OIYMOPNQSA-N
Mol Weight 442.54 g/mol
Molecular Formula C25H22N4O2S
Exact Mass 442.146347 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID dC62pHdnSn
Name (6Z)-5-imino-6-({1-[3-(2-methylphenoxy)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 442.146347136 u
Formula C25H22N4O2S
InChI InChI=1S/C25H22N4O2S/c1-17-7-2-5-10-22(17)31-13-6-11-28-16-18(19-8-3-4-9-21(19)28)15-20-23(26)29-12-14-32-25(29)27-24(20)30/h2-5,7-10,12,14-16,26H,6,11,13H2,1H3/b20-15-,26-23?
InChIKey CLPJCSFQKGMRPJ-OIYMOPNQSA-N
Molecular Weight 442.537 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_43
Solvent DMSO-d6
Source Vendor ID: NMR/12259695