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methyl (2E)-2-{3-[(2,4-difluorophenoxy)methyl]-4-methoxybenzylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID K3kFWmN58Dn
InChI InChI=1S/C31H26F2N2O6S/c1-17-27(30(37)40-4)28(19-6-9-22(38-2)10-7-19)35-29(36)26(42-31(35)34-17)14-18-5-11-24(39-3)20(13-18)16-41-25-12-8-21(32)15-23(25)33/h5-15,28H,16H2,1-4H3/b26-14+
InChIKey OWVUQMDWEGIYON-VULFUBBASA-N
Mol Weight 592.61 g/mol
Molecular Formula C31H26F2N2O6S
Exact Mass 592.147964 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DNMx1KYEWn0
Name methyl (2E)-2-{3-[(2,4-difluorophenoxy)methyl]-4-methoxybenzylidene}-5-(4-methoxyphenyl)-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/C31H26F2N2O6S/c1-17-27(30(37)40-4)28(19-6-9-22(38-2)10-7-19)35-29(36)26(42-31(35)34-17)14-18-5-11-24(39-3)20(13-18)16-41-25-12-8-21(32)15-23(25)33/h5-15,28H,16H2,1-4H3/b26-14+
InChIKey OWVUQMDWEGIYON-VULFUBBASA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10428
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: 1004044; UBI_ID: UBI-010431
Synonyms methyl 2-{3-[(2,4-difluorophenoxy)methyl]-4-methoxybenzylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 318 °C