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

Systemtic Name: 3-[(2-azanyl-7H-purin-8-yl)sulfanyl]propane-1,2-diol Openeye Name: 3-[(2-amino-7H-purin-8-yl)sulfanyl]propane-1,2-diol CAS Name: 3-[(2-amino-7H-purin-8-yl)thio]propane-1,2-diol IUPAC Name: 3-[(2-amino-7H-purin-8-yl)sulfanyl]propane-1,2-diol Traditional Name: 3-[(2-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=C2C(=NC(=N1)N)N=C(N2)SCC(CO)O

Isomeric SMILES

C1=C2C(=NC(=N1)N)N=C(N2)SCC(CO)O

InChI

InChI=1S/C8H11N5O2S/c9-7-10-1-5-6(12-7)13-8(11-5)16-3-4(15)2-14/h1,4,14-15H,2-3H2,(H3,9,10,11,12,13)