methyl 3-(6-methylsulfanylpurin-9-yl)propanoate

Systemtic Name: methyl 3-(6-methylsulfanylpurin-9-yl)propanoate Openeye Name: methyl 3-(6-methylsulfanylpurin-9-yl)propanoate CAS Name: 3-[6-(methylthio)-9-purinyl]propanoic acid methyl ester IUPAC Name: methyl 3-(6-methylsulfanylpurin-9-yl)propanoate Traditional Name: 3-[6-(methylthio)purin-9-yl]propionic acid methyl ester Formula: C10H12N4O2S MolecularWeight: 252.29288

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C=NC2=C1N=CN=C2SC

Isomeric SMILES

COC(=O)CCN1C=NC2=C1N=CN=C2SC

InChI

InChI=1S/C10H12N4O2S/c1-16-7(15)3-4-14-6-13-8-9(14)11-5-12-10(8)17-2/h5-6H,3-4H2,1-2H3