2-(hydroxymethyl)-5-[8-(2-thiophen-2-ylethylamino)purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-[8-(2-thiophen-2-ylethylamino)purin-9-yl]oxolane-3,4-diol Openeye Name: 2-(hydroxymethyl)-5-[8-[2-(2-thienyl)ethylamino]purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[8-(2-thiophen-2-ylethylamino)-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(hydroxymethyl)-5-[8-(2-thiophen-2-ylethylamino)purin-9-yl]oxolane-3,4-diol Traditional Name: 2-methylol-5-[8-[2-(2-thienyl)ethylamino]purin-9-yl]tetrahydrofuran-3,4-diol Formula: C16H19N5O4S MolecularWeight: 377.41816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC2=NC3=CN=CN=C3N2C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1=CSC(=C1)CCNC2=NC3=CN=CN=C3N2C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C16H19N5O4S/c22-7-11-12(23)13(24)15(25-11)21-14-10(6-17-8-19-14)20-16(21)18-4-3-9-2-1-5-26-9/h1-2,5-6,8,11-13,15,22-24H,3-4,7H2,(H,18,20)