(E)-1-[6-azanyl-9-ethyl-8-(3-fluorophenyl)purin-2-yl]-3-ethyl-pent-1-en-3-ol

Systemtic Name: (E)-1-[6-azanyl-9-ethyl-8-(3-fluorophenyl)purin-2-yl]-3-ethyl-pent-1-en-3-ol Openeye Name: (E)-1-[6-amino-9-ethyl-8-(3-fluorophenyl)purin-2-yl]-3-ethyl-pent-1-en-3-ol CAS Name: (E)-1-[6-amino-9-ethyl-8-(3-fluorophenyl)-2-purinyl]-3-ethyl-1-penten-3-ol IUPAC Name: (E)-1-[6-amino-9-ethyl-8-(3-fluorophenyl)purin-2-yl]-3-ethylpent-1-en-3-ol Traditional Name: (E)-1-[6-amino-9-ethyl-8-(3-fluorophenyl)purin-2-yl]-3-ethyl-pent-1-en-3-ol Formula: C20H24FN5O MolecularWeight: 369.435863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C=CC1=NC2=C(C(=N1)N)N=C(N2CC)C3=CC(=CC=C3)F)O

Isomeric SMILES

CCC(CC)(/C=C/C1=NC2=C(C(=N1)N)N=C(N2CC)C3=CC(=CC=C3)F)O

InChI

InChI=1S/C20H24FN5O/c1-4-20(27,5-2)11-10-15-23-17(22)16-19(24-15)26(6-3)18(25-16)13-8-7-9-14(21)12-13/h7-12,27H,4-6H2,1-3H3,(H2,22,23,24)/b11-10+