2-(hydroxymethyl)-5-[2-(phenylmethylsulfanyl)purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-[2-(phenylmethylsulfanyl)purin-9-yl]oxolane-3,4-diol Openeye Name: 2-(2-benzylsulfanylpurin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[2-(phenylmethylthio)-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(2-benzylsulfanylpurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[2-(benzylthio)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=C3C(=N2)N(C=N3)C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=C3C(=N2)N(C=N3)C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C17H18N4O4S/c22-7-12-13(23)14(24)16(25-12)21-9-19-11-6-18-17(20-15(11)21)26-8-10-4-2-1-3-5-10/h1-6,9,12-14,16,22-24H,7-8H2