methyl 2-(8-methoxy-9-methyl-purin-6-yl)sulfanylethanoate

Systemtic Name: methyl 2-(8-methoxy-9-methyl-purin-6-yl)sulfanylethanoate Openeye Name: methyl 2-(8-methoxy-9-methyl-purin-6-yl)sulfanylacetate CAS Name: 2-[(8-methoxy-9-methyl-6-purinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(8-methoxy-9-methylpurin-6-yl)sulfanylacetate Traditional Name: 2-[(8-methoxy-9-methyl-purin-6-yl)thio]acetic acid methyl ester Formula: C10H12N4O3S MolecularWeight: 268.29228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC=N2)SCC(=O)OC)N=C1OC

Isomeric SMILES

CN1C2=C(C(=NC=N2)SCC(=O)OC)N=C1OC

InChI

InChI=1S/C10H12N4O3S/c1-14-8-7(13-10(14)17-3)9(12-5-11-8)18-4-6(15)16-2/h5H,4H2,1-3H3