1-methyl-5-nitro-imidazole-2-carbothioamide

Systemtic Name: 1-methyl-5-nitro-imidazole-2-carbothioamide Openeye Name: 1-methyl-5-nitro-imidazole-2-carbothioamide CAS Name: 1-methyl-5-nitro-2-imidazolecarbothioamide IUPAC Name: 1-methyl-5-nitroimidazole-2-carbothioamide Traditional Name: 1-methyl-5-nitro-imidazole-2-carbothioamide Formula: C5H6N4O2S MolecularWeight: 186.19174

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C(=S)N)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1C(=S)N)[N+](=O)[O-]

InChI

InChI=1S/C5H6N4O2S/c1-8-3(9(10)11)2-7-5(8)4(6)12/h2H,1H3,(H2,6,12)