ethyl 3-[(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[(3-ethyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]benzofuran-2-carboxylate CAS Name: 3-[[(3-ethyl-4-oxo-2-quinazolinyl)thio]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3-ethyl-4-oxoquinazolin-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[(3-ethyl-4-keto-quinazolin-2-yl)thio]methyl]coumarilic acid ethyl ester Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(OC4=CC=CC=C43)C(=O)OCC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(OC4=CC=CC=C43)C(=O)OCC

InChI

InChI=1S/C22H20N2O4S/c1-3-24-20(25)15-10-5-7-11-17(15)23-22(24)29-13-16-14-9-6-8-12-18(14)28-19(16)21(26)27-4-2/h5-12H,3-4,13H2,1-2H3