N-[3-(1H-benzimidazol-2-ylsulfanyl)-4-oxidanyl-naphthalen-1-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(1H-benzimidazol-2-ylsulfanyl)-4-oxidanyl-naphthalen-1-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(1H-benzimidazol-2-ylsulfanyl)-4-hydroxy-1-naphthyl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(1H-benzimidazol-2-ylthio)-4-hydroxy-1-naphthalenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(1H-benzimidazol-2-ylsulfanyl)-4-hydroxynaphthalen-1-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-(1H-benzimidazol-2-ylthio)-4-hydroxy-1-naphthyl]-3-nitro-benzenesulfonamide Formula: C23H16N4O5S2 MolecularWeight: 492.52694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2O)SC3=NC4=CC=CC=C4N3)NS(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2O)SC3=NC4=CC=CC=C4N3)NS(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H16N4O5S2/c28-22-17-9-2-1-8-16(17)20(26-34(31,32)15-7-5-6-14(12-15)27(29)30)13-21(22)33-23-24-18-10-3-4-11-19(18)25-23/h1-13,26,28H,(H,24,25)