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

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ethyl (2E)-5-(4-hydroxyphenyl)-7-methyl-2-[(1-methyl-1H-pyrazol-4-yl)methylene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID Lx5SRIZrf96
InChI InChI=1S/C21H20N4O4S/c1-4-29-20(28)17-12(2)23-21-25(18(17)14-5-7-15(26)8-6-14)19(27)16(30-21)9-13-10-22-24(3)11-13/h5-11,18,26H,4H2,1-3H3/b16-9+
InChIKey NCXQCUZMZLLJMJ-CXUHLZMHSA-N
Mol Weight 424.48 g/mol
Molecular Formula C21H20N4O4S
Exact Mass 424.120526 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4VWDorXCpir
Name ethyl (2E)-5-(4-hydroxyphenyl)-7-methyl-2-[(1-methyl-1H-pyrazol-4-yl)methylene]-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/C21H20N4O4S/c1-4-29-20(28)17-12(2)23-21-25(18(17)14-5-7-15(26)8-6-14)19(27)16(30-21)9-13-10-22-24(3)11-13/h5-11,18,26H,4H2,1-3H3/b16-9+
InChIKey NCXQCUZMZLLJMJ-CXUHLZMHSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_14890
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/1020886; UBI_ID: UBI-014893
Synonyms ethyl 5-(4-hydroxyphenyl)-7-methyl-2-[(1-methyl-1H-pyrazol-4-yl)methylene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 306 °C