N-(4-acetamidophenyl)-3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-acetamidophenyl)-3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-acetamidophenyl)-3-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(4-acetamidophenyl)-3-[(4-oxo-3-phenyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-3-(4-oxo-3-phenylquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(4-acetamidophenyl)-3-[(4-keto-3-phenyl-quinazolin-2-yl)thio]propionamide Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O3S/c1-17(30)26-18-11-13-19(14-12-18)27-23(31)15-16-33-25-28-22-10-6-5-9-21(22)24(32)29(25)20-7-3-2-4-8-20/h2-14H,15-16H2,1H3,(H,26,30)(H,27,31)