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

Systemtic Name: 2-(hydroxymethyl)-5-[8-(2-thiophen-3-ylethylamino)purin-9-yl]oxolane-3,4-diol Openeye Name: 2-(hydroxymethyl)-5-[8-[2-(3-thienyl)ethylamino]purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[8-[2-(3-thiophenyl)ethylamino]-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(hydroxymethyl)-5-[8-(2-thiophen-3-ylethylamino)purin-9-yl]oxolane-3,4-diol Traditional Name: 2-methylol-5-[8-[2-(3-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=C1CCNC2=NC3=CN=CN=C3N2C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1=CSC=C1CCNC2=NC3=CN=CN=C3N2C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C16H19N5O4S/c22-6-11-12(23)13(24)15(25-11)21-14-10(5-17-8-19-14)20-16(21)18-3-1-9-2-4-26-7-9/h2,4-5,7-8,11-13,15,22-24H,1,3,6H2,(H,18,20)