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

Systemtic Name: (3S,4R,5R)-2-[6-azanyl-2-(4-cyclopentylbut-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: (3S,4R,5R)-2-[6-amino-2-(4-cyclopentylbut-1-ynyl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: (3S,4R,5R)-2-[6-amino-2-(4-cyclopentylbut-1-ynyl)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: (3S,4R,5R)-2-[6-amino-2-(4-cyclopentylbut-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: (3S,4R,5R)-2-[6-amino-2-(4-cyclopentylbut-1-ynyl)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC#CC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1CCC(C1)CCC#CC2=NC3=C(C(=N2)N)N=CN3C4[C@H]([C@H]([C@H](O4)CO)O)O

InChI

InChI=1S/C19H25N5O4/c20-17-14-18(23-13(22-17)8-4-3-7-11-5-1-2-6-11)24(10-21-14)19-16(27)15(26)12(9-25)28-19/h10-12,15-16,19,25-27H,1-3,5-7,9H2,(H2,20,22,23)/t12-,15+,16+,19?/m1/s1