1-[(E)-2-[6-azanyl-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]ethenyl]cyclobutan-1-ol

Systemtic Name: 1-[(E)-2-[6-azanyl-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]ethenyl]cyclobutan-1-ol Openeye Name: 1-[(E)-2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]vinyl]cyclobutanol CAS Name: 1-[(E)-2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)-2-purinyl]ethenyl]-1-cyclobutanol IUPAC Name: 1-[(E)-2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]ethenyl]cyclobutan-1-ol Traditional Name: 1-[(E)-2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]vinyl]cyclobutanol Formula: C20H20FN5O MolecularWeight: 365.404103

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(C=CC2=NC3=C(C(=N2)N)N=C(N3C4CC4)C5=CC(=CC=C5)F)O

Isomeric SMILES

C1CC(C1)(/C=C/C2=NC3=C(C(=N2)N)N=C(N3C4CC4)C5=CC(=CC=C5)F)O

InChI

InChI=1S/C20H20FN5O/c21-13-4-1-3-12(11-13)18-25-16-17(22)23-15(7-10-20(27)8-2-9-20)24-19(16)26(18)14-5-6-14/h1,3-4,7,10-11,14,27H,2,5-6,8-9H2,(H2,22,23,24)/b10-7+