[6-(6-chloranyl-2-methylsulfanyl-purin-9-yl)-3,6-dihydro-2H-pyran-3-yl] ethanoate

Systemtic Name: [6-(6-chloranyl-2-methylsulfanyl-purin-9-yl)-3,6-dihydro-2H-pyran-3-yl] ethanoate Openeye Name: [6-(6-chloro-2-methylsulfanyl-purin-9-yl)-3,6-dihydro-2H-pyran-3-yl] acetate CAS Name: acetic acid [6-[6-chloro-2-(methylthio)-9-purinyl]-3,6-dihydro-2H-pyran-3-yl] ester IUPAC Name: [6-(6-chloro-2-methylsulfanylpurin-9-yl)-3,6-dihydro-2H-pyran-3-yl] acetate Traditional Name: acetic acid [6-[6-chloro-2-(methylthio)purin-9-yl]-3,6-dihydro-2H-pyran-3-yl] ester Formula: C13H13ClN4O3S MolecularWeight: 340.78532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C=C1)N2C=NC3=C2N=C(N=C3Cl)SC

Isomeric SMILES

CC(=O)OC1COC(C=C1)N2C=NC3=C2N=C(N=C3Cl)SC

InChI

InChI=1S/C13H13ClN4O3S/c1-7(19)21-8-3-4-9(20-5-8)18-6-15-10-11(14)16-13(22-2)17-12(10)18/h3-4,6,8-9H,5H2,1-2H3