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Diethyl (2E)-5-amino-2-(4-methylbenzylidene)-7-(4-methylphenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate

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Diethyl (2E)-5-amino-2-(4-methylbenzylidene)-7-(4-methylphenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
SpectraBase Compound ID LJ3LOp7rVui
InChI InChI=1S/C28H28N2O5S/c1-5-34-27(32)22-21(19-13-9-17(4)10-14-19)23(28(33)35-6-2)26-30(24(22)29)25(31)20(36-26)15-18-11-7-16(3)8-12-18/h7-15,21H,5-6,29H2,1-4H3/b20-15+
InChIKey XKLBQSKELPQYFC-HMMYKYKNSA-N
Mol Weight 504.6 g/mol
Molecular Formula C28H28N2O5S
Exact Mass 504.171893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVwlQw4NqWz
Name Diethyl (2E)-5-amino-2-(4-methylbenzylidene)-7-(4-methylphenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H28N2O5S
InChI InChI=1S/C28H28N2O5S/c1-5-34-27(32)22-21(19-13-9-17(4)10-14-19)23(28(33)35-6-2)26-30(24(22)29)25(31)20(36-26)15-18-11-7-16(3)8-12-18/h7-15,21H,5-6,29H2,1-4H3/b20-15+
InChIKey XKLBQSKELPQYFC-HMMYKYKNSA-N
Molecular Weight 504.601 g/mol
SMILES NC=1N2C(=C(C(=O)OCC)C(C1C(=O)OCC)c1ccc(cc1)C)S\C(C2=O)=C/c1ccc(cc1)C
SPLASH splash10-03di-0003910000-c198d5d59e2bb8234b07
Source of Spectrum SO-1977-840-3
Synonyms (2E)-5-amino-7-(4-methylphenyl)-2-[(4-methylphenyl)methylidene]-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid diethyl ester Diethyl (2E)-5-amino-7-(4-methylphenyl)-2-[(4-methylphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate Diethyl (2E)-5-amino-3-oxo-7-(p-tolyl)-2-(p-tolylmethylene)-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylate Diethyl (2E)-5-azanyl-7-(4-methylphenyl)-2-[(4-methylphenyl)methylidene]-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
Wiley ID 1537066