ethyl 3-[(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]benzofuran-2-carboxylate CAS Name: 3-[(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)methyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]coumarilic acid ethyl ester Formula: C24H18N2O4S MolecularWeight: 430.47572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C24H18N2O4S/c1-2-29-24(28)21-17(16-10-6-7-11-19(16)30-21)12-26-14-25-22-20(23(26)27)18(13-31-22)15-8-4-3-5-9-15/h3-11,13-14H,2,12H2,1H3