3-(1-methyl-4-nitro-imidazol-2-yl)benzenethiol

Systemtic Name: 3-(1-methyl-4-nitro-imidazol-2-yl)benzenethiol Openeye Name: 3-(1-methyl-4-nitro-imidazol-2-yl)benzenethiol CAS Name: 3-(1-methyl-4-nitro-2-imidazolyl)benzenethiol IUPAC Name: 3-(1-methyl-4-nitroimidazol-2-yl)benzenethiol Traditional Name: 3-(1-methyl-4-nitro-imidazol-2-yl)benzenethiol Formula: C10H9N3O2S MolecularWeight: 235.26236

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C2=CC(=CC=C2)S)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(N=C1C2=CC(=CC=C2)S)[N+](=O)[O-]

InChI

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