2-[6-azanyl-2-(4-cyclopropylbut-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-2-(4-cyclopropylbut-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-(4-cyclopropylbut-1-ynyl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-(4-cyclopropylbut-1-ynyl)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-(4-cyclopropylbut-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-(4-cyclopropylbut-1-ynyl)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C17H21N5O4 MolecularWeight: 359.37974

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CCC#CC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1CC1CCC#CC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C17H21N5O4/c18-15-12-16(21-11(20-15)4-2-1-3-9-5-6-9)22(8-19-12)17-14(25)13(24)10(7-23)26-17/h8-10,13-14,17,23-25H,1,3,5-7H2,(H2,18,20,21)