2-(1-methyl-5-nitro-imidazol-4-yl)sulfanyl-1H-benzimidazole

Systemtic Name: 2-(1-methyl-5-nitro-imidazol-4-yl)sulfanyl-1H-benzimidazole Openeye Name: 2-(1-methyl-5-nitro-imidazol-4-yl)sulfanyl-1H-benzimidazole CAS Name: 2-[(1-methyl-5-nitro-4-imidazolyl)thio]-1H-benzimidazole IUPAC Name: 2-(1-methyl-5-nitroimidazol-4-yl)sulfanyl-1H-benzimidazole Traditional Name: 2-[(1-methyl-5-nitro-imidazol-4-yl)thio]-1H-benzimidazole Formula: C11H9N5O2S MolecularWeight: 275.28646

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1[N+](=O)[O-])SC2=NC3=CC=CC=C3N2

Isomeric SMILES

CN1C=NC(=C1[N+](=O)[O-])SC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C11H9N5O2S/c1-15-6-12-9(10(15)16(17)18)19-11-13-7-4-2-3-5-8(7)14-11/h2-6H,1H3,(H,13,14)