diethyl 5-[2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[[2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]ethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]acetyl]amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C28H25N3O6S MolecularWeight: 531.5796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C28H25N3O6S/c1-3-36-26(34)18-14-19(27(35)37-4-2)16-20(15-18)29-24(32)17-38-28-30-23-13-9-8-12-22(23)25(33)31(28)21-10-6-5-7-11-21/h5-16H,3-4,17H2,1-2H3,(H,29,32)