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(6E)-6-{3-chloro-4-[2-(3,5-dimethylphenoxy)ethoxy]benzylidene}-5-imino-3-methyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID Z4B2nYPN8c
InChI InChI=1S/C24H22ClN3O3S/c1-14-8-15(2)10-18(9-14)30-6-7-31-21-5-4-17(12-20(21)25)11-19-22(26)28-16(3)13-32-24(28)27-23(19)29/h4-5,8-13,26H,6-7H2,1-3H3/b19-11+,26-22?
InChIKey AXUYQBQVMXUAGZ-ULZOKRSMSA-N
Mol Weight 467.97 g/mol
Molecular Formula C24H22ClN3O3S
Exact Mass 467.10704 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7YzWqsTtWHy
Name (6E)-6-{3-chloro-4-[2-(3,5-dimethylphenoxy)ethoxy]benzylidene}-5-imino-3-methyl-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 467.107040451 u
Formula C24H22ClN3O3S
InChI InChI=1S/C24H22ClN3O3S/c1-14-8-15(2)10-18(9-14)30-6-7-31-21-5-4-17(12-20(21)25)11-19-22(26)28-16(3)13-32-24(28)27-23(19)29/h4-5,8-13,26H,6-7H2,1-3H3/b19-11+,26-22?
InChIKey AXUYQBQVMXUAGZ-ULZOKRSMSA-N
Molecular Weight 467.971 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_104
Solvent DMSO-d6
Source Vendor ID: NMR/12259761