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methyl (2E)-5-[4-(dimethylamino)phenyl]-2-{4-methoxy-3-[(2-methylphenoxy)methyl]benzylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID KXiqQfOnQhX
InChI InChI=1S/C33H33N3O5S/c1-20-9-7-8-10-26(20)41-19-24-17-22(11-16-27(24)39-5)18-28-31(37)36-30(23-12-14-25(15-13-23)35(3)4)29(32(38)40-6)21(2)34-33(36)42-28/h7-18,30H,19H2,1-6H3/b28-18+
InChIKey GHFXXMMRISHFJL-MTDXEUNCSA-N
Mol Weight 583.7 g/mol
Molecular Formula C33H33N3O5S
Exact Mass 583.214092 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DlgM4NStGp1
Name methyl (2E)-5-[4-(dimethylamino)phenyl]-2-{4-methoxy-3-[(2-methylphenoxy)methyl]benzylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C33H33N3O5S/c1-20-9-7-8-10-26(20)41-19-24-17-22(11-16-27(24)39-5)18-28-31(37)36-30(23-12-14-25(15-13-23)35(3)4)29(32(38)40-6)21(2)34-33(36)42-28/h7-18,30H,19H2,1-6H3/b28-18+
InChIKey GHFXXMMRISHFJL-MTDXEUNCSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_14993
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/1022275; UBI_ID: UBI-014996
Synonyms methyl 5-[4-(dimethylamino)phenyl]-2-{4-methoxy-3-[(2-methylphenoxy)methyl]benzylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 306 °C