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(6Z)-5-imino-6-{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 9sAk13qQuII
InChI InChI=1S/C28H24N4O4S/c1-18-3-7-20(8-4-18)27-31-32-25(29)24(26(33)30-28(32)37-27)17-19-5-9-22(10-6-19)35-15-16-36-23-13-11-21(34-2)12-14-23/h3-14,17,29H,15-16H2,1-2H3/b24-17-,29-25?
InChIKey CVNJWCAKIJBSGW-MBTLPQJVSA-N
Mol Weight 512.58 g/mol
Molecular Formula C28H24N4O4S
Exact Mass 512.151826 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6T68Yrp0LlF
Name (6Z)-5-imino-6-{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 512.151826439 u
Formula C28H24N4O4S
InChI InChI=1S/C28H24N4O4S/c1-18-3-7-20(8-4-18)27-31-32-25(29)24(26(33)30-28(32)37-27)17-19-5-9-22(10-6-19)35-15-16-36-23-13-11-21(34-2)12-14-23/h3-14,17,29H,15-16H2,1-2H3/b24-17-,29-25?
InChIKey CVNJWCAKIJBSGW-MBTLPQJVSA-N
Molecular Weight 512.584 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_23
Solvent DMSO-d6
Source Vendor ID: NMR/12259671