2-[6-azanyl-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]-1-ethynyl-cyclopentan-1-ol

Systemtic Name: 2-[6-azanyl-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]-1-ethynyl-cyclopentan-1-ol Openeye Name: 2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]-1-ethynyl-cyclopentanol CAS Name: 2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)-2-purinyl]-1-ethynyl-1-cyclopentanol IUPAC Name: 2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]-1-ethynylcyclopentan-1-ol Traditional Name: 2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]-1-ethynyl-cyclopentanol Formula: C21H20FN5O MolecularWeight: 377.414803

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(CCCC1C2=NC3=C(C(=N2)N)N=C(N3C4CC4)C5=CC(=CC=C5)F)O

Isomeric SMILES

C#CC1(CCCC1C2=NC3=C(C(=N2)N)N=C(N3C4CC4)C5=CC(=CC=C5)F)O

InChI

InChI=1S/C21H20FN5O/c1-2-21(28)10-4-7-15(21)18-25-17(23)16-20(26-18)27(14-8-9-14)19(24-16)12-5-3-6-13(22)11-12/h1,3,5-6,11,14-15,28H,4,7-10H2,(H2,23,25,26)