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

Systemtic Name: 2-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-1-(2-phenoxyethyl)benzimidazole Openeye Name: 2-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-1-(2-phenoxyethyl)benzimidazole CAS Name: 2-[(6-nitro-1H-benzimidazol-2-yl)methylthio]-1-(2-phenoxyethyl)benzimidazole IUPAC Name: 2-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-1-(2-phenoxyethyl)benzimidazole Traditional Name: 2-[(6-nitro-1H-benzimidazol-2-yl)methylthio]-1-(2-phenoxyethyl)benzimidazole Formula: C23H19N5O3S MolecularWeight: 445.49366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCN2C3=CC=CC=C3N=C2SCC4=NC5=C(N4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCN2C3=CC=CC=C3N=C2SCC4=NC5=C(N4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O3S/c29-28(30)16-10-11-18-20(14-16)25-22(24-18)15-32-23-26-19-8-4-5-9-21(19)27(23)12-13-31-17-6-2-1-3-7-17/h1-11,14H,12-13,15H2,(H,24,25)