methyl 4-[(E)-[2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoylhydrazinylidene]methyl]benzoate

Systemtic Name: methyl 4-[(E)-[2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoylhydrazinylidene]methyl]benzoate Openeye Name: methyl 4-[(E)-[[2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanylacetyl]hydrazono]methyl]benzoate CAS Name: 4-[(E)-[[1-oxo-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]ethyl]hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-[[2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetyl]hydrazinylidene]methyl]benzoate Traditional Name: 4-[(E)-[[2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]acetyl]hydrazono]methyl]benzoic acid methyl ester Formula: C25H20N4O4S MolecularWeight: 472.5157

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C25H20N4O4S/c1-33-24(32)18-13-11-17(12-14-18)15-26-28-22(30)16-34-25-27-21-10-6-5-9-20(21)23(31)29(25)19-7-3-2-4-8-19/h2-15H,16H2,1H3,(H,28,30)/b26-15+