(1S,2S,3R,5S)-3-(6-aminopurin-9-yl)-5-phenylsulfanyl-cyclopentane-1,2-diol

Systemtic Name: (1S,2S,3R,5S)-3-(6-aminopurin-9-yl)-5-phenylsulfanyl-cyclopentane-1,2-diol Openeye Name: (1S,2S,3R,5S)-3-(6-aminopurin-9-yl)-5-phenylsulfanyl-cyclopentane-1,2-diol CAS Name: (1S,2S,3R,5S)-3-(6-aminopurin-9-yl)-5-(phenylthio)cyclopentane-1,2-diol IUPAC Name: (1S,2S,3R,5S)-3-(6-aminopurin-9-yl)-5-phenylsulfanylcyclopentane-1,2-diol Traditional Name: (1S,2S,3R,5S)-3-adenin-9-yl-5-(phenylthio)cyclopentane-1,2-diol Formula: C16H17N5O2S MolecularWeight: 343.40348

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C1SC2=CC=CC=C2)O)O)N3C=NC4=C3N=CN=C4N

Isomeric SMILES

C1[C@H]([C@@H]([C@@H]([C@H]1SC2=CC=CC=C2)O)O)N3C=NC4=C3N=CN=C4N

InChI

InChI=1S/C16H17N5O2S/c17-15-12-16(19-7-18-15)21(8-20-12)10-6-11(14(23)13(10)22)24-9-4-2-1-3-5-9/h1-5,7-8,10-11,13-14,22-23H,6H2,(H2,17,18,19)/t10-,11+,13+,14-/m1/s1