6-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-7,9-dihydropurin-8-one

Systemtic Name: 6-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-7,9-dihydropurin-8-one Openeye Name: 6-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-7,9-dihydropurin-8-one CAS Name: 6-[(3-methyl-5-nitro-4-imidazolyl)thio]-7,9-dihydropurin-8-one IUPAC Name: 6-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-7,9-dihydropurin-8-one Traditional Name: 6-[(3-methyl-5-nitro-imidazol-4-yl)thio]-7,9-dihydropurin-8-one Formula: C9H7N7O3S MolecularWeight: 293.26198

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=NC=NC3=C2NC(=O)N3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=NC=NC3=C2NC(=O)N3)[N+](=O)[O-]

InChI

InChI=1S/C9H7N7O3S/c1-15-3-12-6(16(18)19)8(15)20-7-4-5(10-2-11-7)14-9(17)13-4/h2-3H,1H3,(H2,10,11,13,14,17)