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(2E)-5-(4-fluorophenyl)-2-[(4-hydroxy-3-methoxyphenyl)methylidene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
SpectraBase Compound ID 3m5mhT7x3NS
InChI InChI=1S/C24H21FN2O5S/c1-4-32-23(30)20-13(2)26-24-27(21(20)15-6-8-16(25)9-7-15)22(29)19(33-24)12-14-5-10-17(28)18(11-14)31-3/h5-12,21,28H,4H2,1-3H3/b19-12+
InChIKey ONJKAAPXYSBORD-XDHOZWIPSA-N
Mol Weight 468.5 g/mol
Molecular Formula C24H21FN2O5S
Exact Mass 468.115521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LnekBSSqHb
Name (2E)-5-(4-fluorophenyl)-2-[(4-hydroxy-3-methoxyphenyl)methylidene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21FN2O5S
InChI InChI=1S/C24H21FN2O5S/c1-4-32-23(30)20-13(2)26-24-27(21(20)15-6-8-16(25)9-7-15)22(29)19(33-24)12-14-5-10-17(28)18(11-14)31-3/h5-12,21,28H,4H2,1-3H3/b19-12+
InChIKey ONJKAAPXYSBORD-XDHOZWIPSA-N
Molecular Weight 468.499 g/mol
SMILES Oc1ccc(\C=C/2C(N3C(=NC(=C(C3c3ccc(cc3)F)C(=O)OCC)C)S2)=O)cc1OC
SPLASH splash10-00kr-2903100000-562a7ecc34f260bf407d
Synonyms (2E)-5-(4-fluorophenyl)-3-keto-7-methyl-2-vanillylidene-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester Ethyl (2E)-5-(4-fluorophenyl)-2-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Ethyl (2E)-5-(4-fluorophenyl)-2-[(4-hydroxy-3-methoxy-phenyl)methylene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate Ethyl (2E)-5-(4-fluorophenyl)-2-[(4-hydroxy-3-methoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Ethyl 5-(4-fluorophenyl)-2-(4-hydroxy-3-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Wiley ID 1454417