O-[5-(6-aminopurin-9-yl)-2-ethyl-oxolan-3-yl] methylsulfanylmethanethioate

Systemtic Name: O-[5-(6-aminopurin-9-yl)-2-ethyl-oxolan-3-yl] methylsulfanylmethanethioate Openeye Name: O-[5-(6-aminopurin-9-yl)-2-ethyl-tetrahydrofuran-3-yl] methylsulfanylmethanethioate CAS Name: (methylthio)methanethioic acid O-[5-(6-aminopurin-9-yl)-2-ethyl-3-oxolanyl] ester IUPAC Name: O-[5-(6-aminopurin-9-yl)-2-ethyloxolan-3-yl] methylsulfanylmethanethioate Traditional Name: (methylthio)methanethioic acid O-(5-adenin-9-yl-2-ethyl-tetrahydrofuran-3-yl) ester Formula: C13H17N5O2S2 MolecularWeight: 339.43638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(CC(O1)N2C=NC3=C2N=CN=C3N)OC(=S)SC

Isomeric SMILES

CCC1C(CC(O1)N2C=NC3=C2N=CN=C3N)OC(=S)SC

InChI

InChI=1S/C13H17N5O2S2/c1-3-7-8(20-13(21)22-2)4-9(19-7)18-6-17-10-11(14)15-5-16-12(10)18/h5-9H,3-4H2,1-2H3,(H2,14,15,16)