2-[(6-azanyl-7H-purin-8-yl)sulfanyl]-6-(hydroxymethyl)oxane-3,4,5-triol

Systemtic Name: 2-[(6-azanyl-7H-purin-8-yl)sulfanyl]-6-(hydroxymethyl)oxane-3,4,5-triol Openeye Name: 2-[(6-amino-7H-purin-8-yl)sulfanyl]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol CAS Name: 2-[(6-amino-7H-purin-8-yl)thio]-6-(hydroxymethyl)oxane-3,4,5-triol IUPAC Name: 2-[(6-amino-7H-purin-8-yl)sulfanyl]-6-(hydroxymethyl)oxane-3,4,5-triol Traditional Name: 2-[(6-amino-7H-purin-8-yl)thio]-6-methylol-tetrahydropyran-3,4,5-triol Formula: C11H15N5O5S MolecularWeight: 329.3323

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)NC(=N2)SC3C(C(C(C(O3)CO)O)O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)NC(=N2)SC3C(C(C(C(O3)CO)O)O)O

InChI

InChI=1S/C11H15N5O5S/c12-8-4-9(14-2-13-8)16-11(15-4)22-10-7(20)6(19)5(18)3(1-17)21-10/h2-3,5-7,10,17-20H,1H2,(H3,12,13,14,15,16)