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

Systemtic Name: 2-[2-azanyl-6-(sulfanylmethyl)purin-9-yl]oxy-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[2-amino-6-(sulfanylmethyl)purin-9-yl]oxy-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[[2-amino-6-(mercaptomethyl)-9-purinyl]oxy]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[2-amino-6-(sulfanylmethyl)purin-9-yl]oxy-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[2-amino-6-(mercaptomethyl)purin-9-yl]oxy-5-methylol-tetrahydrofuran-3,4-diol Formula: C11H15N5O5S MolecularWeight: 329.3323

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N=C(N=C2N1OC3C(C(C(O3)CO)O)O)N)CS

Isomeric SMILES

C1=NC2=C(N=C(N=C2N1OC3C(C(C(O3)CO)O)O)N)CS

InChI

InChI=1S/C11H15N5O5S/c12-11-14-4(2-22)6-9(15-11)16(3-13-6)21-10-8(19)7(18)5(1-17)20-10/h3,5,7-8,10,17-19,22H,1-2H2,(H2,12,14,15)