2-azanyl-9-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-3H-purine-6-thione

Systemtic Name: 2-azanyl-9-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-3H-purine-6-thione Openeye Name: 2-amino-9-[[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl]-3H-purine-6-thione CAS Name: 2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-3H-purine-6-thione IUPAC Name: 2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-3H-purine-6-thione Traditional Name: 2-amino-9-[(2-hydroxy-1-methylol-ethoxy)methyl]-3H-purine-6-thione Formula: C9H13N5O3S MolecularWeight: 271.29622

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1COC(CO)CO)NC(=NC2=S)N

Isomeric SMILES

C1=NC2=C(N1COC(CO)CO)NC(=NC2=S)N

InChI

InChI=1S/C9H13N5O3S/c10-9-12-7-6(8(18)13-9)11-3-14(7)4-17-5(1-15)2-16/h3,5,15-16H,1-2,4H2,(H3,10,12,13,18)