2-[6-azanyl-2-(5-iodanylthiophen-2-yl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-2-(5-iodanylthiophen-2-yl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-(5-iodo-2-thienyl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-(5-iodo-2-thiophenyl)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-(5-iodothiophen-2-yl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-(5-iodo-2-thienyl)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C14H14IN5O4S MolecularWeight: 475.26153

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)I)C2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1=C(SC(=C1)I)C2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C14H14IN5O4S/c15-7-2-1-6(25-7)12-18-11(16)8-13(19-12)20(4-17-8)14-10(23)9(22)5(3-21)24-14/h1-2,4-5,9-10,14,21-23H,3H2,(H2,16,18,19)