N-methyl-3-nitro-4-[1-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethylamino]benzenesulfonamide

Systemtic Name: N-methyl-3-nitro-4-[1-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethylamino]benzenesulfonamide Openeye Name: N-methyl-3-nitro-4-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]benzenesulfonamide CAS Name: N-methyl-3-nitro-4-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]benzenesulfonamide IUPAC Name: N-methyl-3-nitro-4-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]benzenesulfonamide Traditional Name: 4-[1-(2-keto-1,3-dihydrobenzimidazol-5-yl)ethylamino]-N-methyl-3-nitro-benzenesulfonamide Formula: C16H17N5O5S MolecularWeight: 391.40168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)NC(=O)N2)NC3=C(C=C(C=C3)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC2=C(C=C1)NC(=O)N2)NC3=C(C=C(C=C3)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C16H17N5O5S/c1-9(10-3-5-12-14(7-10)20-16(22)19-12)18-13-6-4-11(27(25,26)17-2)8-15(13)21(23)24/h3-9,17-18H,1-2H3,(H2,19,20,22)