(2R,3S,5R)-5-(6-azanyl-2-chloranyl-8-methylsulfanyl-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: (2R,3S,5R)-5-(6-azanyl-2-chloranyl-8-methylsulfanyl-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol Openeye Name: (2R,3S,5R)-5-(6-amino-2-chloro-8-methylsulfanyl-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: (2R,3S,5R)-5-[6-amino-2-chloro-8-(methylthio)-9-purinyl]-2-(hydroxymethyl)-3-oxolanol IUPAC Name: (2R,3S,5R)-5-(6-amino-2-chloro-8-methylsulfanylpurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol Traditional Name: (2R,3S,5R)-5-[6-amino-2-chloro-8-(methylthio)purin-9-yl]-2-methylol-tetrahydrofuran-3-ol Formula: C11H14ClN5O3S MolecularWeight: 331.77856

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(N1C3CC(C(O3)CO)O)N=C(N=C2N)Cl

Isomeric SMILES

CSC1=NC2=C(N1[C@H]3C[C@@H]([C@H](O3)CO)O)N=C(N=C2N)Cl

InChI

InChI=1S/C11H14ClN5O3S/c1-21-11-14-7-8(13)15-10(12)16-9(7)17(11)6-2-4(19)5(3-18)20-6/h4-6,18-19H,2-3H2,1H3,(H2,13,15,16)/t4-,5+,6+/m0/s1