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

Systemtic Name: 4-[2-[4-oxidanylidene-2-(2-oxidanylideneazepan-3-yl)sulfanyl-quinazolin-3-yl]ethyl]benzenesulfonamide Openeye Name: 4-[2-[4-oxo-2-(2-oxoazepan-3-yl)sulfanyl-quinazolin-3-yl]ethyl]benzenesulfonamide CAS Name: 4-[2-[4-oxo-2-[(2-oxo-3-azepanyl)thio]-3-quinazolinyl]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[4-oxo-2-(2-oxoazepan-3-yl)sulfanylquinazolin-3-yl]ethyl]benzenesulfonamide Traditional Name: 4-[2-[4-keto-2-[(2-ketoazepan-3-yl)thio]quinazolin-3-yl]ethyl]benzenesulfonamide Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)SC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CCNC(=O)C(C1)SC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C22H24N4O4S2/c23-32(29,30)16-10-8-15(9-11-16)12-14-26-21(28)17-5-1-2-6-18(17)25-22(26)31-19-7-3-4-13-24-20(19)27/h1-2,5-6,8-11,19H,3-4,7,12-14H2,(H,24,27)(H2,23,29,30)