(2S,3S,5R)-5-(6-aminopurin-9-yl)-2-(2-hydroxyethylsulfanylmethyl)oxolan-3-ol

Systemtic Name: (2S,3S,5R)-5-(6-aminopurin-9-yl)-2-(2-hydroxyethylsulfanylmethyl)oxolan-3-ol Openeye Name: (2S,3S,5R)-5-(6-aminopurin-9-yl)-2-(2-hydroxyethylsulfanylmethyl)tetrahydrofuran-3-ol CAS Name: (2S,3S,5R)-5-(6-aminopurin-9-yl)-2-[(2-hydroxyethylthio)methyl]-3-oxolanol IUPAC Name: (2S,3S,5R)-5-(6-aminopurin-9-yl)-2-(2-hydroxyethylsulfanylmethyl)oxolan-3-ol Traditional Name: (2S,3S,5R)-5-adenin-9-yl-2-[(2-hydroxyethylthio)methyl]tetrahydrofuran-3-ol Formula: C12H17N5O3S MolecularWeight: 311.36008

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3N)CSCCO)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2N=CN=C3N)CSCCO)O

InChI

InChI=1S/C12H17N5O3S/c13-11-10-12(15-5-14-11)17(6-16-10)9-3-7(19)8(20-9)4-21-2-1-18/h5-9,18-19H,1-4H2,(H2,13,14,15)/t7-,8+,9+/m0/s1