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methyl (2E)-2-[(1,5-dimethyl-1H-pyrazol-4-yl)methylene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID EElfc8RJjR4
InChI InChI=1S/C21H20N4O3S/c1-12-17(20(27)28-4)18(14-8-6-5-7-9-14)25-19(26)16(29-21(25)23-12)10-15-11-22-24(3)13(15)2/h5-11,18H,1-4H3/b16-10+
InChIKey FGXTTWHUXXPEAA-MHWRWJLKSA-N
Mol Weight 408.48 g/mol
Molecular Formula C21H20N4O3S
Exact Mass 408.125612 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5znVCCQPZv1
Name methyl (2E)-2-[(1,5-dimethyl-1H-pyrazol-4-yl)methylene]-7-methyl-3-oxo-5-phenyl-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/C21H20N4O3S/c1-12-17(20(27)28-4)18(14-8-6-5-7-9-14)25-19(26)16(29-21(25)23-12)10-15-11-22-24(3)13(15)2/h5-11,18H,1-4H3/b16-10+
InChIKey FGXTTWHUXXPEAA-MHWRWJLKSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_7329
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: 9686301; UBI_ID: UBI-007332
Synonyms methyl 2-[(1,5-dimethyl-1H-pyrazol-4-yl)methylene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 308 °C