2-[(1-methylimidazol-2-yl)sulfanylmethyl]-6-nitro-1H-benzimidazole

Systemtic Name: 2-[(1-methylimidazol-2-yl)sulfanylmethyl]-6-nitro-1H-benzimidazole Openeye Name: 2-[(1-methylimidazol-2-yl)sulfanylmethyl]-6-nitro-1H-benzimidazole CAS Name: 2-[[(1-methyl-2-imidazolyl)thio]methyl]-6-nitro-1H-benzimidazole IUPAC Name: 2-[(1-methylimidazol-2-yl)sulfanylmethyl]-6-nitro-1H-benzimidazole Traditional Name: 2-[[(1-methylimidazol-2-yl)thio]methyl]-6-nitro-1H-benzimidazole Formula: C12H11N5O2S MolecularWeight: 289.31304

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1SCC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H11N5O2S/c1-16-5-4-13-12(16)20-7-11-14-9-3-2-8(17(18)19)6-10(9)15-11/h2-6H,7H2,1H3,(H,14,15)