2,2,2-tris(fluoranyl)-N-[3-[[9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-6-yl]amino]propyl]ethanamide

Systemtic Name: 2,2,2-tris(fluoranyl)-N-[3-[[9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-6-yl]amino]propyl]ethanamide Openeye Name: N-[3-[[9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]amino]propyl]-2,2,2-trifluoro-acetamide CAS Name: N-[3-[[9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-purinyl]amino]propyl]-2,2,2-trifluoroacetamide IUPAC Name: N-[3-[[9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]propyl]-2,2,2-trifluoroacetamide Traditional Name: N-[3-[[9-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)purin-6-yl]amino]propyl]-2,2,2-trifluoro-acetamide Formula: C15H19F3N6O5 MolecularWeight: 420.34377

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)NCCCNC(=O)C(F)(F)F)N=CN2C3C(C(C(O3)CO)O)O

Isomeric SMILES

C1=NC2=C(C(=N1)NCCCNC(=O)C(F)(F)F)N=CN2C3C(C(C(O3)CO)O)O

InChI

InChI=1S/C15H19F3N6O5/c16-15(17,18)14(28)20-3-1-2-19-11-8-12(22-5-21-11)24(6-23-8)13-10(27)9(26)7(4-25)29-13/h5-7,9-10,13,25-27H,1-4H2,(H,20,28)(H,19,21,22)