2-azanyl-9-(2-hydroxyethyloxymethyl)-8-methylsulfanyl-3H-purin-6-one

Systemtic Name: 2-azanyl-9-(2-hydroxyethyloxymethyl)-8-methylsulfanyl-3H-purin-6-one Openeye Name: 2-amino-9-(2-hydroxyethoxymethyl)-8-methylsulfanyl-3H-purin-6-one CAS Name: 2-amino-9-(2-hydroxyethoxymethyl)-8-(methylthio)-3H-purin-6-one IUPAC Name: 2-amino-9-(2-hydroxyethoxymethyl)-8-methylsulfanyl-3H-purin-6-one Traditional Name: 2-amino-9-(2-hydroxyethoxymethyl)-8-(methylthio)-3H-purin-6-one Formula: C9H13N5O3S MolecularWeight: 271.29622

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(N1COCCO)NC(=NC2=O)N

Isomeric SMILES

CSC1=NC2=C(N1COCCO)NC(=NC2=O)N

InChI

InChI=1S/C9H13N5O3S/c1-18-9-11-5-6(12-8(10)13-7(5)16)14(9)4-17-3-2-15/h15H,2-4H2,1H3,(H3,10,12,13,16)