ethyl 4-[3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylpropanoylamino]benzoate

Systemtic Name: ethyl 4-[3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylpropanoylamino]benzoate Openeye Name: ethyl 4-[3-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanylpropanoylamino]benzoate CAS Name: 4-[[1-oxo-3-[(4-oxo-3-phenyl-2-quinazolinyl)thio]propyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-oxo-3-phenylquinazolin-2-yl)sulfanylpropanoylamino]benzoate Traditional Name: 4-[3-[(4-keto-3-phenyl-quinazolin-2-yl)thio]propanoylamino]benzoic acid ethyl ester Formula: C26H23N3O4S MolecularWeight: 473.54352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C26H23N3O4S/c1-2-33-25(32)18-12-14-19(15-13-18)27-23(30)16-17-34-26-28-22-11-7-6-10-21(22)24(31)29(26)20-8-4-3-5-9-20/h3-15H,2,16-17H2,1H3,(H,27,30)