6-nitro-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-benzimidazole

Systemtic Name: 6-nitro-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-benzimidazole Openeye Name: 6-nitro-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-1H-benzimidazole CAS Name: 6-nitro-2-[[(1-phenyl-5-tetrazolyl)thio]methyl]-1H-benzimidazole IUPAC Name: 6-nitro-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-1H-benzimidazole Traditional Name: 6-nitro-2-[[(1-phenyltetrazol-5-yl)thio]methyl]-1H-benzimidazole Formula: C15H11N7O2S MolecularWeight: 353.35854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C15H11N7O2S/c23-22(24)11-6-7-12-13(8-11)17-14(16-12)9-25-15-18-19-20-21(15)10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)