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(2E)-5-amino-3-keto-7-(4-methoxyphenyl)-2-p-anisylidene-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid diethyl ester
SpectraBase Compound ID Es5MXCeuK4T
InChI InChI=1S/C28H28N2O7S/c1-5-36-27(32)22-21(17-9-13-19(35-4)14-10-17)23(28(33)37-6-2)26-30(24(22)29)25(31)20(38-26)15-16-7-11-18(34-3)12-8-16/h7-15,21H,5-6,29H2,1-4H3/b20-15+
InChIKey MKQSVMZJYBKMOG-HMMYKYKNSA-N
Mol Weight 536.6 g/mol
Molecular Formula C28H28N2O7S
Exact Mass 536.161722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhAqoXfAnLn
Name (2E)-5-amino-3-keto-7-(4-methoxyphenyl)-2-p-anisylidene-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid diethyl ester
Alternate Name(s) (2E)-5-amino-7-(4-methoxyphenyl)-2-[(4-methoxyphenyl)methylidene]-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid diethyl ester Diethyl (2E)-5-amino-7-(4-methoxyphenyl)-2-[(4-methoxyphenyl)methylene]-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylate Diethyl (2E)-5-amino-7-(4-methoxyphenyl)-2-[(4-methoxyphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate Diethyl (2E)-5-azanyl-7-(4-methoxyphenyl)-2-[(4-methoxyphenyl)methylidene]-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
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Formula C28H28N2O7S
InChI InChI=1S/C28H28N2O7S/c1-5-36-27(32)22-21(17-9-13-19(35-4)14-10-17)23(28(33)37-6-2)26-30(24(22)29)25(31)20(38-26)15-16-7-11-18(34-3)12-8-16/h7-15,21H,5-6,29H2,1-4H3/b20-15+
InChIKey MKQSVMZJYBKMOG-HMMYKYKNSA-N
Molecular Weight 536.599 g/mol
SMILES NC=1N2C(=C(C(=O)OCC)C(C1C(=O)OCC)c1ccc(cc1)OC)S\C(C2=O)=C/c1ccc(cc1)OC
SPLASH splash10-004i-0000910000-ba50799e47db21e89e78
Source of Spectrum SO-1977-840-3
Wiley ID 1537065