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5H-Thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-2,3-dihydro-7-methyl-3-oxo-5-phenyl-, methyl ester
SpectraBase Compound ID 8RjlSY8Pe2y
InChI InChI=1S/C29H23FN2O4S/c1-18-25(28(34)35-2)26(20-8-4-3-5-9-20)32-27(33)24(37-29(32)31-18)16-19-12-14-22(15-13-19)36-17-21-10-6-7-11-23(21)30/h3-16,26H,17H2,1-2H3/b24-16+
InChIKey AGAMSODARNNSAE-LFVJCYFKSA-N
Mol Weight 514.57 g/mol
Molecular Formula C29H23FN2O4S
Exact Mass 514.136257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2wKVzxmiEp1
Name 5H-Thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-2,3-dihydro-7-methyl-3-oxo-5-phenyl-, methyl ester
Alternate Name(s) (2E)-2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Methyl (2E)-2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Methyl (2E)-2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate Methyl (2E)-2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-7-methyl-3-oxidanylidene-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
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Formula C29H23FN2O4S
InChI InChI=1S/C29H23FN2O4S/c1-18-25(28(34)35-2)26(20-8-4-3-5-9-20)32-27(33)24(37-29(32)31-18)16-19-12-14-22(15-13-19)36-17-21-10-6-7-11-23(21)30/h3-16,26H,17H2,1-2H3/b24-16+
InChIKey AGAMSODARNNSAE-LFVJCYFKSA-N
Molecular Weight 514.571 g/mol
SMILES c1ccc(COc2ccc(\C=C/3C(N4C(=NC(=C(C4c4ccccc4)C(=O)OC)C)S3)=O)cc2)c(F)c1
SPLASH splash10-0a4i-2910100000-cb3f1e5fc9d045904b20
Source of Spectrum IY-1-4507-7
Wiley ID 1653060