For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

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

View entire compound with spectra: 2 NMR

ethyl (2Z)-7-methyl-2-[(1-methyl-1H-pyrazol-4-yl)methylene]-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID 3NZhEtdLkBo
InChI InChI=1S/C21H20N4O3S/c1-4-28-20(27)17-13(2)23-21-25(18(17)15-8-6-5-7-9-15)19(26)16(29-21)10-14-11-22-24(3)12-14/h5-12,18H,4H2,1-3H3/b16-10-
InChIKey AYYLKSPWNLDZCF-YBEGLDIGSA-N
Mol Weight 408.48 g/mol
Molecular Formula C21H20N4O3S
Exact Mass 408.125612 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID ivOLLaa4VI
Name Ethyl (2Z)-7-methyl-2-[(1-methyl-1H-pyrazol-4-yl)methylene]-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-A]pyrimidine-6-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.125611691 u
Formula C21H20N4O3S
InChI InChI=1S/C21H20N4O3S/c1-4-28-20(27)17-13(2)23-21-25(18(17)15-8-6-5-7-9-15)19(26)16(29-21)10-14-11-22-24(3)12-14/h5-12,18H,4H2,1-3H3/b16-10-
InChIKey AYYLKSPWNLDZCF-YBEGLDIGSA-N
Molecular Weight 408.476 g/mol
SMILES C1=CC=C(C2C(=C(C)N=C3N2C(\C(=C\C2=CN(C)N=C2)S3)=O)C(=O)OCC)C=C1