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

Systemtic Name: 2-[6-azanyl-2-(5-phenylthiophen-2-yl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-(5-phenyl-2-thienyl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-(5-phenyl-2-thiophenyl)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-(5-phenylthiophen-2-yl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-(5-phenyl-2-thienyl)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C20H19N5O4S MolecularWeight: 425.46096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(S2)C3=NC4=C(C(=N3)N)N=CN4C5C(C(C(O5)CO)O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(S2)C3=NC4=C(C(=N3)N)N=CN4C5C(C(C(O5)CO)O)O

InChI

InChI=1S/C20H19N5O4S/c21-17-14-19(25(9-22-14)20-16(28)15(27)11(8-26)29-20)24-18(23-17)13-7-6-12(30-13)10-4-2-1-3-5-10/h1-7,9,11,15-16,20,26-28H,8H2,(H2,21,23,24)