2-(hydroxymethyl)-5-[2-(oxidanylamino)-6-(phenylmethylsulfanyl)purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-[2-(oxidanylamino)-6-(phenylmethylsulfanyl)purin-9-yl]oxolane-3,4-diol Openeye Name: 2-[6-benzylsulfanyl-2-(hydroxyamino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[2-(hydroxyamino)-6-(phenylmethylthio)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-benzylsulfanyl-2-(hydroxyamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-(benzylthio)-2-(hydroxyamino)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C17H19N5O5S MolecularWeight: 405.42826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)NO

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)NO

InChI

InChI=1S/C17H19N5O5S/c23-6-10-12(24)13(25)16(27-10)22-8-18-11-14(22)19-17(21-26)20-15(11)28-7-9-4-2-1-3-5-9/h1-5,8,10,12-13,16,23-26H,6-7H2,(H,19,20,21)