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(2E)-2-[(1-ethyl-3-pyrazolyl)methylidene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester
SpectraBase Compound ID HzN4kz6vBwC
InChI InChI=1S/C21H20N4O3S/c1-4-24-11-10-15(23-24)12-16-19(26)25-18(14-8-6-5-7-9-14)17(20(27)28-3)13(2)22-21(25)29-16/h5-12,18H,4H2,1-3H3/b16-12+
InChIKey AAWJDNHGMOMMTL-FOWTUZBSSA-N
Mol Weight 408.48 g/mol
Molecular Formula C21H20N4O3S
Exact Mass 408.125612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BC0oKkdRYmo
Name (2E)-2-[(1-ethyl-3-pyrazolyl)methylidene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester
Alternate Name(s) (2E)-2-[(1-ethylpyrazol-3-yl)methylene]-3-keto-7-methyl-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Methyl (2E)-2-[(1-ethylpyrazol-3-yl)methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate Methyl (2E)-2-[(1-ethylpyrazol-3-yl)methylidene]-7-methyl-3-oxidanylidene-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Methyl (2E)-2-[(1-ethylpyrazol-3-yl)methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
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Formula C21H20N4O3S
InChI InChI=1S/C21H20N4O3S/c1-4-24-11-10-15(23-24)12-16-19(26)25-18(14-8-6-5-7-9-14)17(20(27)28-3)13(2)22-21(25)29-16/h5-12,18H,4H2,1-3H3/b16-12+
InChIKey AAWJDNHGMOMMTL-FOWTUZBSSA-N
Molecular Weight 408.476 g/mol
SMILES c1ccc(C2C(C(=O)OC)=C(N=C3N2C(\C(=C/c2n[n](CC)cc2)S3)=O)C)cc1
SPLASH splash10-001i-5619100000-491566a0cc4cc1a9a529
Wiley ID 1445041