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(6Z)-5-imino-6-{3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]benzylidene}-2-(4-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID H5cQHlA7NcE
InChI InChI=1S/C29H26N4O5S/c1-18-4-7-20(8-5-18)28-32-33-26(30)23(27(34)31-29(33)39-28)16-19-6-13-24(25(17-19)36-3)38-15-14-37-22-11-9-21(35-2)10-12-22/h4-13,16-17,30H,14-15H2,1-3H3/b23-16-,30-26?
InChIKey NOFJLRCOYPWGRC-WNUQXASFSA-N
Mol Weight 542.61 g/mol
Molecular Formula C29H26N4O5S
Exact Mass 542.162391 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 74xfXsQPk05
Name (6Z)-5-imino-6-{3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]benzylidene}-2-(4-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[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 542.162391122 u
Formula C29H26N4O5S
InChI InChI=1S/C29H26N4O5S/c1-18-4-7-20(8-5-18)28-32-33-26(30)23(27(34)31-29(33)39-28)16-19-6-13-24(25(17-19)36-3)38-15-14-37-22-11-9-21(35-2)10-12-22/h4-13,16-17,30H,14-15H2,1-3H3/b23-16-,30-26?
InChIKey NOFJLRCOYPWGRC-WNUQXASFSA-N
Molecular Weight 542.610 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_27
Solvent DMSO-d6
Source Vendor ID: NMR/12259675