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

View entire compound with spectra: 2 NMR

ethyl (2Z)-5-[4-(acetyloxy)phenyl]-2-(3-chlorobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID 67VBjw9yoPw
InChI InChI=1S/C25H21ClN2O5S/c1-4-32-24(31)21-14(2)27-25-28(22(21)17-8-10-19(11-9-17)33-15(3)29)23(30)20(34-25)13-16-6-5-7-18(26)12-16/h5-13,22H,4H2,1-3H3/b20-13-
InChIKey HNVQKAKUFKBPFP-MOSHPQCFSA-N
Mol Weight 496.97 g/mol
Molecular Formula C25H21ClN2O5S
Exact Mass 496.085971 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dz3okkS3bnC
Name Ethyl (2Z)-5-[4-(acetyloxy)phenyl]-2-(3-chlorobenzylidene)-7-methyl-3-oxo-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 496.085970653 u
Formula C25H21ClN2O5S
InChI InChI=1S/C25H21ClN2O5S/c1-4-32-24(31)21-14(2)27-25-28(22(21)17-8-10-19(11-9-17)33-15(3)29)23(30)20(34-25)13-16-6-5-7-18(26)12-16/h5-13,22H,4H2,1-3H3/b20-13-
InChIKey HNVQKAKUFKBPFP-MOSHPQCFSA-N
Molecular Weight 496.965 g/mol
SMILES CCOC(C=1C(N2C(=NC1C)S\C(C2=O)=C\C=1C=C(Cl)C=CC1)C=1C=CC(OC(=O)C)=CC1)=O