4-bromanyl-N-[2-(6-nitro-3-oxidanyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-N-phenyl-benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[2-(6-nitro-3-oxidanyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-N-phenyl-benzenesulfonamide Openeye Name: 4-bromo-N-[2-(3-hydroxy-6-nitro-4-oxo-quinazolin-2-yl)ethyl]-N-phenyl-benzenesulfonamide CAS Name: 4-bromo-N-[2-(3-hydroxy-6-nitro-4-oxo-2-quinazolinyl)ethyl]-N-phenylbenzenesulfonamide IUPAC Name: 4-bromo-N-[2-(3-hydroxy-6-nitro-4-oxoquinazolin-2-yl)ethyl]-N-phenylbenzenesulfonamide Traditional Name: 4-bromo-N-[2-(3-hydroxy-4-keto-6-nitro-quinazolin-2-yl)ethyl]-N-phenyl-benzenesulfonamide Formula: C22H17BrN4O6S MolecularWeight: 545.36258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2O)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)N(CCC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2O)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrN4O6S/c23-15-6-9-18(10-7-15)34(32,33)25(16-4-2-1-3-5-16)13-12-21-24-20-11-8-17(27(30)31)14-19(20)22(28)26(21)29/h1-11,14,29H,12-13H2