(2R,3S,4R)-2-[(6-aminopurin-9-yl)-ethylsulfanyl-methyl]oxolane-3,4-diol

Systemtic Name: (2R,3S,4R)-2-[(6-aminopurin-9-yl)-ethylsulfanyl-methyl]oxolane-3,4-diol Openeye Name: (2R,3S,4R)-2-[(6-aminopurin-9-yl)-ethylsulfanyl-methyl]tetrahydrofuran-3,4-diol CAS Name: (2R,3S,4R)-2-[(6-aminopurin-9-yl)-(ethylthio)methyl]oxolane-3,4-diol IUPAC Name: (2R,3S,4R)-2-[(6-aminopurin-9-yl)-ethylsulfanylmethyl]oxolane-3,4-diol Traditional Name: (2R,3S,4R)-2-[adenin-9-yl-(ethylthio)methyl]tetrahydrofuran-3,4-diol Formula: C12H17N5O3S MolecularWeight: 311.36008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(C1C(C(CO1)O)O)N2C=NC3=C2N=CN=C3N

Isomeric SMILES

CCSC([C@H]1[C@H]([C@@H](CO1)O)O)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C12H17N5O3S/c1-2-21-12(9-8(19)6(18)3-20-9)17-5-16-7-10(13)14-4-15-11(7)17/h4-6,8-9,12,18-19H,2-3H2,1H3,(H2,13,14,15)/t6-,8+,9-,12?/m1/s1