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

Systemtic Name: ethyl 3-[[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanylmethyl]benzofuran-2-carboxylate CAS Name: 3-[[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]methyl]coumarilic acid ethyl ester Formula: C27H22N2O4S MolecularWeight: 470.53958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C

InChI

InChI=1S/C27H22N2O4S/c1-3-32-26(31)24-21(19-8-5-7-11-23(19)33-24)16-34-27-28-22-10-6-4-9-20(22)25(30)29(27)18-14-12-17(2)13-15-18/h4-15H,3,16H2,1-2H3