3-[(6-azanyl-7H-purin-8-yl)sulfanyl]propane-1,2-diol

Systemtic Name: 3-[(6-azanyl-7H-purin-8-yl)sulfanyl]propane-1,2-diol Openeye Name: 3-[(6-amino-7H-purin-8-yl)sulfanyl]propane-1,2-diol CAS Name: 3-[(6-amino-7H-purin-8-yl)thio]propane-1,2-diol IUPAC Name: 3-[(6-amino-7H-purin-8-yl)sulfanyl]propane-1,2-diol Traditional Name: 3-[(6-amino-7H-purin-8-yl)thio]propane-1,2-diol Formula: C8H11N5O2S MolecularWeight: 241.27024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11N5O2S/c9-6-5-7(11-3-10-6)13-8(12-5)16-2-4(15)1-14/h3-4,14-15H,1-2H2,(H3,9,10,11,12,13)