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methyl (2E)-2-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID 2r6evBGiG6G
InChI InChI=1S/C23H24N4O4S/c1-6-26-12-16(13(2)25-26)11-18-21(28)27-20(15-7-9-17(30-4)10-8-15)19(22(29)31-5)14(3)24-23(27)32-18/h7-12,20H,6H2,1-5H3/b18-11+
InChIKey QRBNYXFCIQLYBO-WOJGMQOQSA-N
Mol Weight 452.53 g/mol
Molecular Formula C23H24N4O4S
Exact Mass 452.151826 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G50AXG1Q0gW
Name methyl (2E)-2-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)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/C23H24N4O4S/c1-6-26-12-16(13(2)25-26)11-18-21(28)27-20(15-7-9-17(30-4)10-8-15)19(22(29)31-5)14(3)24-23(27)32-18/h7-12,20H,6H2,1-5H3/b18-11+
InChIKey QRBNYXFCIQLYBO-WOJGMQOQSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10419
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: 1003948; UBI_ID: UBI-010422
Synonyms methyl 2-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 318 °C