4-(7-nitro-4-oxidanylidene-2-propyl-quinazolin-3-yl)benzenesulfonamide

Systemtic Name: 4-(7-nitro-4-oxidanylidene-2-propyl-quinazolin-3-yl)benzenesulfonamide Openeye Name: 4-(7-nitro-4-oxo-2-propyl-quinazolin-3-yl)benzenesulfonamide CAS Name: 4-(7-nitro-4-oxo-2-propyl-3-quinazolinyl)benzenesulfonamide IUPAC Name: 4-(7-nitro-4-oxo-2-propylquinazolin-3-yl)benzenesulfonamide Traditional Name: 4-(4-keto-7-nitro-2-propyl-quinazolin-3-yl)benzenesulfonamide Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCCC1=NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C17H16N4O5S/c1-2-3-16-19-15-10-12(21(23)24)6-9-14(15)17(22)20(16)11-4-7-13(8-5-11)27(18,25)26/h4-10H,2-3H2,1H3,(H2,18,25,26)