2-azanyl-7-[2-(2-hydroxyethylsulfanyl)ethyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-7-[2-(2-hydroxyethylsulfanyl)ethyl]-3H-purin-6-one Openeye Name: 2-amino-7-[2-(2-hydroxyethylsulfanyl)ethyl]-3H-purin-6-one CAS Name: 2-amino-7-[2-(2-hydroxyethylthio)ethyl]-3H-purin-6-one IUPAC Name: 2-amino-7-[2-(2-hydroxyethylsulfanyl)ethyl]-3H-purin-6-one Traditional Name: 2-amino-7-[2-(2-hydroxyethylthio)ethyl]-3H-purin-6-one Formula: C9H13N5O2S MolecularWeight: 255.29682

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCSCCO)C(=O)N=C(N2)N

Isomeric SMILES

C1=NC2=C(N1CCSCCO)C(=O)N=C(N2)N

InChI

InChI=1S/C9H13N5O2S/c10-9-12-7-6(8(16)13-9)14(5-11-7)1-3-17-4-2-15/h5,15H,1-4H2,(H3,10,12,13,16)