6-(3-methyl-5-nitro-imidazol-4-yl)-1,7-dihydropurine-2-thione

Systemtic Name: 6-(3-methyl-5-nitro-imidazol-4-yl)-1,7-dihydropurine-2-thione Openeye Name: 6-(3-methyl-5-nitro-imidazol-4-yl)-1,7-dihydropurine-2-thione CAS Name: 6-(3-methyl-5-nitro-4-imidazolyl)-1,7-dihydropurine-2-thione IUPAC Name: 6-(3-methyl-5-nitroimidazol-4-yl)-1,7-dihydropurine-2-thione Traditional Name: 6-(3-methyl-5-nitro-imidazol-4-yl)-1,7-dihydropurine-2-thione Formula: C9H7N7O2S MolecularWeight: 277.26258

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1C2=C3C(=NC(=S)N2)N=CN3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1C2=C3C(=NC(=S)N2)N=CN3)[N+](=O)[O-]

InChI

InChI=1S/C9H7N7O2S/c1-15-3-12-8(16(17)18)6(15)4-5-7(11-2-10-5)14-9(19)13-4/h2-3H,1H3,(H2,10,11,13,14,19)