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(2E)-3-keto-5-(4-methoxyphenyl)-7-methyl-2-[3-[2-(4-methylphenoxy)ethoxy]benzylidene]-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
SpectraBase Compound ID 7o6MPKJwlbC
InChI InChI=1S/C33H32N2O6S/c1-5-39-32(37)29-22(3)34-33-35(30(29)24-11-15-25(38-4)16-12-24)31(36)28(42-33)20-23-7-6-8-27(19-23)41-18-17-40-26-13-9-21(2)10-14-26/h6-16,19-20,30H,5,17-18H2,1-4H3/b28-20+
InChIKey CKKMXUXHPUSIBR-VFCFBJKWSA-N
Mol Weight 584.7 g/mol
Molecular Formula C33H32N2O6S
Exact Mass 584.198108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Wg8Xdj9nM
Name (2E)-3-keto-5-(4-methoxyphenyl)-7-methyl-2-[3-[2-(4-methylphenoxy)ethoxy]benzylidene]-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
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Formula C33H32N2O6S
InChI InChI=1S/C33H32N2O6S/c1-5-39-32(37)29-22(3)34-33-35(30(29)24-11-15-25(38-4)16-12-24)31(36)28(42-33)20-23-7-6-8-27(19-23)41-18-17-40-26-13-9-21(2)10-14-26/h6-16,19-20,30H,5,17-18H2,1-4H3/b28-20+
InChIKey CKKMXUXHPUSIBR-VFCFBJKWSA-N
Molecular Weight 584.687 g/mol
SMILES CCOC(C=1C(N2C(=NC1C)S\C(C2=O)=C/c1cc(OCCOc2ccc(cc2)C)ccc1)c1ccc(cc1)OC)=O
SPLASH splash10-01t9-0100590000-9e1d63f9853b7f662885
Synonyms (2E)-5-(4-methoxyphenyl)-7-methyl-2-[[3-[2-(4-methylphenoxy)ethoxy]phenyl]methylidene]-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester Ethyl (2E)-5-(4-methoxyphenyl)-7-methyl-2-[[3-[2-(4-methylphenoxy)ethoxy]phenyl]methylene]-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate Ethyl (2E)-5-(4-methoxyphenyl)-7-methyl-2-[[3-[2-(4-methylphenoxy)ethoxy]phenyl]methylidene]-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Ethyl (2E)-5-(4-methoxyphenyl)-7-methyl-2-[[3-[2-(4-methylphenoxy)ethoxy]phenyl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Ethyl (2E)-5-(4-methoxyphenyl)-7-methyl-2-{3-[2-(4-methylphenoxy)ethoxy]benzylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Wiley ID 1436565