(2R,3R,4S)-2-(6-azanyl-8-methyl-purin-9-yl)-5-(2-methylsulfanyl-2-oxidanyl-ethyl)oxolane-3,4-diol

Systemtic Name: (2R,3R,4S)-2-(6-azanyl-8-methyl-purin-9-yl)-5-(2-methylsulfanyl-2-oxidanyl-ethyl)oxolane-3,4-diol Openeye Name: (2R,3R,4S)-2-(6-amino-8-methyl-purin-9-yl)-5-(2-hydroxy-2-methylsulfanyl-ethyl)tetrahydrofuran-3,4-diol CAS Name: (2R,3R,4S)-2-(6-amino-8-methyl-9-purinyl)-5-[2-hydroxy-2-(methylthio)ethyl]oxolane-3,4-diol IUPAC Name: (2R,3R,4S)-2-(6-amino-8-methylpurin-9-yl)-5-(2-hydroxy-2-methylsulfanylethyl)oxolane-3,4-diol Traditional Name: (2R,3R,4S)-2-(6-amino-8-methyl-purin-9-yl)-5-[2-hydroxy-2-(methylthio)ethyl]tetrahydrofuran-3,4-diol Formula: C13H19N5O4S MolecularWeight: 341.38606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3C(C(C(O3)CC(O)SC)O)O)N=CN=C2N

Isomeric SMILES

CC1=NC2=C(N1[C@H]3[C@@H]([C@@H](C(O3)CC(O)SC)O)O)N=CN=C2N

InChI

InChI=1S/C13H19N5O4S/c1-5-17-8-11(14)15-4-16-12(8)18(5)13-10(21)9(20)6(22-13)3-7(19)23-2/h4,6-7,9-10,13,19-21H,3H2,1-2H3,(H2,14,15,16)/t6?,7?,9-,10-,13-/m1/s1