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(2E)-2-[(1-ethyl-3-pyrazolyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester
SpectraBase Compound ID COtxTujjbQh
InChI InChI=1S/C22H22N4O4S/c1-5-25-11-10-15(24-25)12-17-20(27)26-19(14-6-8-16(29-3)9-7-14)18(21(28)30-4)13(2)23-22(26)31-17/h6-12,19H,5H2,1-4H3/b17-12+
InChIKey SKBZIECTXYCANI-SFQUDFHCSA-N
Mol Weight 438.5 g/mol
Molecular Formula C22H22N4O4S
Exact Mass 438.136176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FeLZF2Df0OD
Name (2E)-2-[(1-ethyl-3-pyrazolyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester
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Formula C22H22N4O4S
InChI InChI=1S/C22H22N4O4S/c1-5-25-11-10-15(24-25)12-17-20(27)26-19(14-6-8-16(29-3)9-7-14)18(21(28)30-4)13(2)23-22(26)31-17/h6-12,19H,5H2,1-4H3/b17-12+
InChIKey SKBZIECTXYCANI-SFQUDFHCSA-N
Molecular Weight 438.502 g/mol
SMILES CC[n]1nc(\C=C/2C(N3C(=NC(C)=C(C3c3ccc(cc3)OC)C(=O)OC)S2)=O)cc1
SPLASH splash10-0f89-5719200000-612cb757002fce55dead
Synonyms (2E)-2-[(1-ethylpyrazol-3-yl)methylene]-3-keto-5-(4-methoxyphenyl)-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Methyl (2E)-2-[(1-ethylpyrazol-3-yl)methylene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate Methyl (2E)-2-[(1-ethylpyrazol-3-yl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Methyl (2E)-2-[(1-ethylpyrazol-3-yl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Wiley ID 1445042