ethyl 6-methylsulfanylpurine-7-carboxylate

Systemtic Name: ethyl 6-methylsulfanylpurine-7-carboxylate Openeye Name: ethyl 6-methylsulfanylpurine-7-carboxylate CAS Name: 6-(methylthio)-7-purinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-methylsulfanylpurine-7-carboxylate Traditional Name: 6-(methylthio)purine-7-carboxylic acid ethyl ester Formula: C9H10N4O2S MolecularWeight: 238.2663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=NC2=C1C(=NC=N2)SC

Isomeric SMILES

CCOC(=O)N1C=NC2=C1C(=NC=N2)SC

InChI

InChI=1S/C9H10N4O2S/c1-3-15-9(14)13-5-12-7-6(13)8(16-2)11-4-10-7/h4-5H,3H2,1-2H3