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

Systemtic Name: 5-[2-azanyl-6-(3-methyl-5-nitro-imidazol-4-yl)selanyl-purin-9-yl]-2-(hydroxymethyl)oxolan-3-ol Openeye Name: 5-[2-amino-6-(3-methyl-5-nitro-imidazol-4-yl)selanyl-purin-9-yl]-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: 5-[2-amino-6-[(3-methyl-5-nitro-4-imidazolyl)seleno]-9-purinyl]-2-(hydroxymethyl)-3-oxolanol IUPAC Name: 5-[2-amino-6-(3-methyl-5-nitroimidazol-4-yl)selanylpurin-9-yl]-2-(hydroxymethyl)oxolan-3-ol Traditional Name: 5-[2-amino-6-[(3-methyl-5-nitro-imidazol-4-yl)seleno]purin-9-yl]-2-methylol-tetrahydrofuran-3-ol Formula: C14H16N8O5Se MolecularWeight: 455.28744

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1[Se]C2=NC(=NC3=C2N=CN3C4CC(C(O4)CO)O)N)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1[Se]C2=NC(=NC3=C2N=CN3C4CC(C(O4)CO)O)N)[N+](=O)[O-]

InChI

InChI=1S/C14H16N8O5Se/c1-20-4-17-11(22(25)26)13(20)28-12-9-10(18-14(15)19-12)21(5-16-9)8-2-6(24)7(3-23)27-8/h4-8,23-24H,2-3H2,1H3,(H2,15,18,19)