2-(hydroxymethyl)-5-[6-(3-methyl-5-nitro-imidazol-4-yl)sulfanylpurin-9-yl]oxolan-3-ol

Systemtic Name: 2-(hydroxymethyl)-5-[6-(3-methyl-5-nitro-imidazol-4-yl)sulfanylpurin-9-yl]oxolan-3-ol Openeye Name: 2-(hydroxymethyl)-5-[6-(3-methyl-5-nitro-imidazol-4-yl)sulfanylpurin-9-yl]tetrahydrofuran-3-ol CAS Name: 2-(hydroxymethyl)-5-[6-[(3-methyl-5-nitro-4-imidazolyl)thio]-9-purinyl]-3-oxolanol IUPAC Name: 2-(hydroxymethyl)-5-[6-(3-methyl-5-nitroimidazol-4-yl)sulfanylpurin-9-yl]oxolan-3-ol Traditional Name: 5-[6-[(3-methyl-5-nitro-imidazol-4-yl)thio]purin-9-yl]-2-methylol-tetrahydrofuran-3-ol Formula: C14H15N7O5S MolecularWeight: 393.3778

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=NC=NC3=C2N=CN3C4CC(C(O4)CO)O)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=NC=NC3=C2N=CN3C4CC(C(O4)CO)O)[N+](=O)[O-]

InChI

InChI=1S/C14H15N7O5S/c1-19-5-18-12(21(24)25)14(19)27-13-10-11(15-4-16-13)20(6-17-10)9-2-7(23)8(3-22)26-9/h4-9,22-23H,2-3H2,1H3