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

Systemtic Name: 1-[2-[6-azanyl-8-(3-fluorophenyl)-9-(2-hydroxyethyl)purin-2-yl]ethynyl]cyclopentan-1-ol Openeye Name: 1-[2-[6-amino-8-(3-fluorophenyl)-9-(2-hydroxyethyl)purin-2-yl]ethynyl]cyclopentanol CAS Name: 1-[2-[6-amino-8-(3-fluorophenyl)-9-(2-hydroxyethyl)-2-purinyl]ethynyl]-1-cyclopentanol IUPAC Name: 1-[2-[6-amino-8-(3-fluorophenyl)-9-(2-hydroxyethyl)purin-2-yl]ethynyl]cyclopentan-1-ol Traditional Name: 1-[2-[6-amino-8-(3-fluorophenyl)-9-(2-hydroxyethyl)purin-2-yl]ethynyl]cyclopentanol Formula: C20H20FN5O2 MolecularWeight: 381.403503

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#CC2=NC3=C(C(=N2)N)N=C(N3CCO)C4=CC(=CC=C4)F)O

Isomeric SMILES

C1CCC(C1)(C#CC2=NC3=C(C(=N2)N)N=C(N3CCO)C4=CC(=CC=C4)F)O

InChI

InChI=1S/C20H20FN5O2/c21-14-5-3-4-13(12-14)18-25-16-17(22)23-15(24-19(16)26(18)10-11-27)6-9-20(28)7-1-2-8-20/h3-5,12,27-28H,1-2,7-8,10-11H2,(H2,22,23,24)