2-(hydroxymethyl)-5-[6-(3-methyl-5-nitro-imidazol-4-yl)sulfanylpurin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-[6-(3-methyl-5-nitro-imidazol-4-yl)sulfanylpurin-9-yl]oxolane-3,4-diol Openeye Name: 2-(hydroxymethyl)-5-[6-(3-methyl-5-nitro-imidazol-4-yl)sulfanylpurin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[6-[(3-methyl-5-nitro-4-imidazolyl)thio]-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(hydroxymethyl)-5-[6-(3-methyl-5-nitroimidazol-4-yl)sulfanylpurin-9-yl]oxolane-3,4-diol Traditional Name: 2-[6-[(3-methyl-5-nitro-imidazol-4-yl)thio]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C14H15N7O6S MolecularWeight: 409.3772

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H15N7O6S/c1-19-4-18-11(21(25)26)14(19)28-12-7-10(15-3-16-12)20(5-17-7)13-9(24)8(23)6(2-22)27-13/h3-6,8-9,13,22-24H,2H2,1H3