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

Systemtic Name: methyl 2-[2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoylamino]benzoate Openeye Name: methyl 2-[[2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanylacetyl]amino]benzoate CAS Name: 2-[[1-oxo-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C24H19N3O4S MolecularWeight: 445.49036

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C24H19N3O4S/c1-31-23(30)18-12-6-8-14-20(18)25-21(28)15-32-24-26-19-13-7-5-11-17(19)22(29)27(24)16-9-3-2-4-10-16/h2-14H,15H2,1H3,(H,25,28)