6-nitro-2-[[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-1H-benzimidazole

Systemtic Name: 6-nitro-2-[[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-1H-benzimidazole Openeye Name: 6-nitro-2-[[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-1H-benzimidazole CAS Name: 6-nitro-2-[[2-[[(6-nitro-1H-benzimidazol-2-yl)thio]methyl]phenyl]methylthio]-1H-benzimidazole IUPAC Name: 6-nitro-2-[[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-1H-benzimidazole Traditional Name: 6-nitro-2-[[2-[[(6-nitro-1H-benzimidazol-2-yl)thio]methyl]benzyl]thio]-1H-benzimidazole Formula: C22H16N6O4S2 MolecularWeight: 492.53024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])CSC4=NC5=C(N4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])CSC4=NC5=C(N4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H16N6O4S2/c29-27(30)15-5-7-17-19(9-15)25-21(23-17)33-11-13-3-1-2-4-14(13)12-34-22-24-18-8-6-16(28(31)32)10-20(18)26-22/h1-10H,11-12H2,(H,23,25)(H,24,26)