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(2Z)-2-(3-bromo-5-ethoxy-4-propargyloxy-benzylidene)-3-keto-7-methyl-5-p-cumenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
SpectraBase Compound ID KOAEDUAGLk0
InChI InChI=1S/C31H31BrN2O5S/c1-7-14-39-28-23(32)15-20(16-24(28)37-8-2)17-25-29(35)34-27(22-12-10-21(11-13-22)18(4)5)26(30(36)38-9-3)19(6)33-31(34)40-25/h1,10-13,15-18,27H,8-9,14H2,2-6H3/b25-17-
InChIKey GLHAPCCVVDZYCS-UQQQWYQISA-N
Mol Weight 623.56 g/mol
Molecular Formula C31H31BrN2O5S
Exact Mass 622.113706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AYojUJEf5Mn
Name (2Z)-2-(3-bromo-5-ethoxy-4-propargyloxy-benzylidene)-3-keto-7-methyl-5-p-cumenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
Alternate Name(s) (2Z)-2-[(3-bromo-5-ethoxy-4-prop-2-ynoxyphenyl)methylidene]-7-methyl-3-oxo-5-(4-propan-2-ylphenyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester Ethyl (2Z)-2-[(3-bromanyl-5-ethoxy-4-prop-2-ynoxy-phenyl)methylidene]-7-methyl-3-oxidanylidene-5-(4-propan-2-ylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Ethyl (2Z)-2-[(3-bromo-5-ethoxy-4-prop-2-ynoxy-phenyl)methylene]-5-(4-isopropylphenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate Ethyl (2Z)-2-[(3-bromo-5-ethoxy-4-prop-2-ynoxyphenyl)methylidene]-7-methyl-3-oxo-5-(4-propan-2-ylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Ethyl 2-[3-bromo-5-ethoxy-4-(2-propynyloxy)benzylidene]-5-(4-isopropylphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
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Formula C31H31BrN2O5S
InChI InChI=1S/C31H31BrN2O5S/c1-7-14-39-28-23(32)15-20(16-24(28)37-8-2)17-25-29(35)34-27(22-12-10-21(11-13-22)18(4)5)26(30(36)38-9-3)19(6)33-31(34)40-25/h1,10-13,15-18,27H,8-9,14H2,2-6H3/b25-17-
InChIKey GLHAPCCVVDZYCS-UQQQWYQISA-N
Molecular Weight 623.562 g/mol
SMILES CCOC(C=1C(N2C(=NC1C)S\C(C2=O)=C\c1cc(Br)c(c(c1)OCC)OCC#C)c1ccc(cc1)C(C)C)=O
SPLASH splash10-0076-8970010000-9433561091055e24be17
Wiley ID 1454407