N-[[3-(1H-imidazol-5-ylmethyl)-7-nitro-2-oxidanylidene-3,4-dihydro-1H-quinoxalin-5-yl]methyl]benzenesulfonamide

Systemtic Name: N-[[3-(1H-imidazol-5-ylmethyl)-7-nitro-2-oxidanylidene-3,4-dihydro-1H-quinoxalin-5-yl]methyl]benzenesulfonamide Openeye Name: N-[[3-(1H-imidazol-5-ylmethyl)-7-nitro-2-oxo-3,4-dihydro-1H-quinoxalin-5-yl]methyl]benzenesulfonamide CAS Name: N-[[3-(1H-imidazol-5-ylmethyl)-7-nitro-2-oxo-3,4-dihydro-1H-quinoxalin-5-yl]methyl]benzenesulfonamide IUPAC Name: N-[[3-(1H-imidazol-5-ylmethyl)-7-nitro-2-oxo-3,4-dihydro-1H-quinoxalin-5-yl]methyl]benzenesulfonamide Traditional Name: N-[[3-(1H-imidazol-5-ylmethyl)-2-keto-7-nitro-3,4-dihydro-1H-quinoxalin-5-yl]methyl]benzenesulfonamide Formula: C19H18N6O5S MolecularWeight: 442.44842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCC2=CC(=CC3=C2NC(C(=O)N3)CC4=CN=CN4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCC2=CC(=CC3=C2NC(C(=O)N3)CC4=CN=CN4)[N+](=O)[O-]

InChI

InChI=1S/C19H18N6O5S/c26-19-17(7-13-10-20-11-21-13)23-18-12(6-14(25(27)28)8-16(18)24-19)9-22-31(29,30)15-4-2-1-3-5-15/h1-6,8,10-11,17,22-23H,7,9H2,(H,20,21)(H,24,26)