(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(ethoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(ethoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(ethoxymethyl)-2-benzofurancarboxylic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(ethoxymethyl)coumarilic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C19H16N2O5S MolecularWeight: 384.40574

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(OC2=CC=CC=C21)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

CCOCC1=C(OC2=CC=CC=C21)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C19H16N2O5S/c1-2-24-9-12-11-5-3-4-6-14(11)26-16(12)19(23)25-10-15-20-13-7-8-27-17(13)18(22)21-15/h3-8H,2,9-10H2,1H3,(H,20,21,22)