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(2E)-2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methylene]-5-(4-methoxyphenyl)-7-methyl-N-(2-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SpectraBase Compound ID 5BClu7wBtZW
InChI InChI=1S/C30H31N5O3S/c1-7-34-20(5)23(18(3)33-34)16-25-29(37)35-27(21-12-14-22(38-6)15-13-21)26(19(4)31-30(35)39-25)28(36)32-24-11-9-8-10-17(24)2/h8-16,27H,7H2,1-6H3,(H,32,36)/b25-16+
InChIKey UAYRMXURHSEDCV-PCLIKHOPSA-N
Mol Weight 541.67 g/mol
Molecular Formula C30H31N5O3S
Exact Mass 541.214761 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JkwebwyNhXU
Name (2E)-2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methylene]-5-(4-methoxyphenyl)-7-methyl-N-(2-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C30H31N5O3S/c1-7-34-20(5)23(18(3)33-34)16-25-29(37)35-27(21-12-14-22(38-6)15-13-21)26(19(4)31-30(35)39-25)28(36)32-24-11-9-8-10-17(24)2/h8-16,27H,7H2,1-6H3,(H,32,36)/b25-16+
InChIKey UAYRMXURHSEDCV-PCLIKHOPSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8883
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/1264170; Labnumber: FED0495; UZI_ID: UZI-008885
Synonyms 2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methylene]-5-(4-methoxyphenyl)-7-methyl-N-(2-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Temperature 318 °C