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(2E)-5-amino-2-(4-chlorobenzylidene)-7-(4-chlorophenyl)-3-keto-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid diethyl ester
SpectraBase Compound ID 3OSU14BuuNi
InChI InChI=1S/C26H22Cl2N2O5S/c1-3-34-25(32)20-19(15-7-11-17(28)12-8-15)21(26(33)35-4-2)24-30(22(20)29)23(31)18(36-24)13-14-5-9-16(27)10-6-14/h5-13,19H,3-4,29H2,1-2H3/b18-13+
InChIKey IPOZMEPMBZGRFY-QGOAFFKASA-N
Mol Weight 545.44 g/mol
Molecular Formula C26H22Cl2N2O5S
Exact Mass 544.062648 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eth0ZUUyBig
Name (2E)-5-amino-2-(4-chlorobenzylidene)-7-(4-chlorophenyl)-3-keto-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid diethyl ester
Alternate Name(s) (2E)-5-amino-7-(4-chlorophenyl)-2-[(4-chlorophenyl)methylidene]-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid diethyl ester Diethyl (2E)-5-amino-7-(4-chlorophenyl)-2-[(4-chlorophenyl)methylene]-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylate Diethyl (2E)-5-amino-7-(4-chlorophenyl)-2-[(4-chlorophenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate Diethyl (2E)-5-azanyl-7-(4-chlorophenyl)-2-[(4-chlorophenyl)methylidene]-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
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Formula C26H22Cl2N2O5S
InChI InChI=1S/C26H22Cl2N2O5S/c1-3-34-25(32)20-19(15-7-11-17(28)12-8-15)21(26(33)35-4-2)24-30(22(20)29)23(31)18(36-24)13-14-5-9-16(27)10-6-14/h5-13,19H,3-4,29H2,1-2H3/b18-13+
InChIKey IPOZMEPMBZGRFY-QGOAFFKASA-N
Molecular Weight 545.437 g/mol
SMILES NC=1N2C(=C(C(=O)OCC)C(C1C(=O)OCC)c1ccc(cc1)Cl)S\C(C2=O)=C/c1ccc(cc1)Cl
SPLASH splash10-053r-0003940000-854f8a6e20f96462b27f
Source of Spectrum SO-1977-840-3
Wiley ID 1537064