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ethyl (2E)-2-[(5-bromo-2-thienyl)methylene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

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ethyl (2E)-2-[(5-bromo-2-thienyl)methylene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID 4yu84qGe7y
InChI InChI=1S/C22H19BrN2O4S2/c1-4-29-21(27)18-12(2)24-22-25(19(18)13-5-7-14(28-3)8-6-13)20(26)16(31-22)11-15-9-10-17(23)30-15/h5-11,19H,4H2,1-3H3/b16-11+
InChIKey YYXZFVJLWXSDHC-LFIBNONCSA-N
Mol Weight 519.43 g/mol
Molecular Formula C22H19BrN2O4S2
Exact Mass 517.996962 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I9ENm8VNFJS
Name ethyl (2E)-2-[(5-bromo-2-thienyl)methylene]-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/C22H19BrN2O4S2/c1-4-29-21(27)18-12(2)24-22-25(19(18)13-5-7-14(28-3)8-6-13)20(26)16(31-22)11-15-9-10-17(23)30-15/h5-11,19H,4H2,1-3H3/b16-11+
InChIKey YYXZFVJLWXSDHC-LFIBNONCSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8609
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: 9686652; UBI_ID: UBI-008612
Synonyms ethyl 2-[(5-bromo-2-thienyl)methylene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 308 °C