2-[2-azanyl-6,8-bis(methylsulfanyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[2-azanyl-6,8-bis(methylsulfanyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[2-amino-6,8-bis(methylsulfanyl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[2-amino-6,8-bis(methylthio)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[2-amino-6,8-bis(methylsulfanyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[2-amino-6,8-bis(methylthio)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C12H17N5O4S2 MolecularWeight: 359.42448

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC2=C1N=C(N2C3C(C(C(O3)CO)O)O)SC)N

Isomeric SMILES

CSC1=NC(=NC2=C1N=C(N2C3C(C(C(O3)CO)O)O)SC)N

InChI

InChI=1S/C12H17N5O4S2/c1-22-9-5-8(15-11(13)16-9)17(12(14-5)23-2)10-7(20)6(19)4(3-18)21-10/h4,6-7,10,18-20H,3H2,1-2H3,(H2,13,15,16)