2-(3-methyl-5-nitro-imidazol-4-yl)benzenethiol

Systemtic Name: 2-(3-methyl-5-nitro-imidazol-4-yl)benzenethiol Openeye Name: 2-(3-methyl-5-nitro-imidazol-4-yl)benzenethiol CAS Name: 2-(3-methyl-5-nitro-4-imidazolyl)benzenethiol IUPAC Name: 2-(3-methyl-5-nitroimidazol-4-yl)benzenethiol Traditional Name: 2-(3-methyl-5-nitro-imidazol-4-yl)benzenethiol Formula: C10H9N3O2S MolecularWeight: 235.26236

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1C2=CC=CC=C2S)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1C2=CC=CC=C2S)[N+](=O)[O-]

InChI

InChI=1S/C10H9N3O2S/c1-12-6-11-10(13(14)15)9(12)7-4-2-3-5-8(7)16/h2-6,16H,1H3