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ethyl (2Z)-5-(4-chlorophenyl)-2-(4-hydroxybenzylidene)-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-chlorophenyl)-2-(4-hydroxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID DI8jMmg3e3w
InChI InChI=1S/C23H19ClN2O4S/c1-3-30-22(29)19-13(2)25-23-26(20(19)15-6-8-16(24)9-7-15)21(28)18(31-23)12-14-4-10-17(27)11-5-14/h4-12,20,27H,3H2,1-2H3/b18-12-
InChIKey WPVUJHCNRJPVHH-PDGQHHTCSA-N
Mol Weight 454.93 g/mol
Molecular Formula C23H19ClN2O4S
Exact Mass 454.075406 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FqLvxqs5Jch
Name Ethyl (2Z)-5-(4-chlorophenyl)-2-(4-hydroxybenzylidene)-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 454.075405970 u
Formula C23H19ClN2O4S
InChI InChI=1S/C23H19ClN2O4S/c1-3-30-22(29)19-13(2)25-23-26(20(19)15-6-8-16(24)9-7-15)21(28)18(31-23)12-14-4-10-17(27)11-5-14/h4-12,20,27H,3H2,1-2H3/b18-12-
InChIKey WPVUJHCNRJPVHH-PDGQHHTCSA-N
Molecular Weight 454.928 g/mol
SMILES OC=1C=CC(\C=C\2C(N3C(=NC(=C(C3C=3C=CC(=CC3)Cl)C(=O)OCC)C)S2)=O)=CC1