4-[2-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)ethyl]benzenesulfonamide

Systemtic Name: 4-[2-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)ethyl]benzenesulfonamide Openeye Name: 4-[2-(4-oxo-2-phenacylsulfanyl-quinazolin-3-yl)ethyl]benzenesulfonamide CAS Name: 4-[2-[4-oxo-2-(phenacylthio)-3-quinazolinyl]ethyl]benzenesulfonamide IUPAC Name: 4-[2-(4-oxo-2-phenacylsulfanylquinazolin-3-yl)ethyl]benzenesulfonamide Traditional Name: 4-[2-[4-keto-2-(phenacylthio)quinazolin-3-yl]ethyl]benzenesulfonamide Formula: C24H21N3O4S2 MolecularWeight: 479.57124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C24H21N3O4S2/c25-33(30,31)19-12-10-17(11-13-19)14-15-27-23(29)20-8-4-5-9-21(20)26-24(27)32-16-22(28)18-6-2-1-3-7-18/h1-13H,14-16H2,(H2,25,30,31)