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

Systemtic Name: 1-[2-[8-(3-fluorophenyl)-9-methyl-6-(methylamino)purin-2-yl]ethynyl]cyclopentan-1-ol Openeye Name: 1-[2-[8-(3-fluorophenyl)-9-methyl-6-(methylamino)purin-2-yl]ethynyl]cyclopentanol CAS Name: 1-[2-[8-(3-fluorophenyl)-9-methyl-6-(methylamino)-2-purinyl]ethynyl]-1-cyclopentanol IUPAC Name: 1-[2-[8-(3-fluorophenyl)-9-methyl-6-(methylamino)purin-2-yl]ethynyl]cyclopentan-1-ol Traditional Name: 1-[2-[8-(3-fluorophenyl)-9-methyl-6-(methylamino)purin-2-yl]ethynyl]cyclopentanol Formula: C20H20FN5O MolecularWeight: 365.404103

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1N=C(N2C)C3=CC(=CC=C3)F)C#CC4(CCCC4)O

Isomeric SMILES

CNC1=NC(=NC2=C1N=C(N2C)C3=CC(=CC=C3)F)C#CC4(CCCC4)O

InChI

InChI=1S/C20H20FN5O/c1-22-17-16-19(24-15(23-17)8-11-20(27)9-3-4-10-20)26(2)18(25-16)13-6-5-7-14(21)12-13/h5-7,12,27H,3-4,9-10H2,1-2H3,(H,22,23,24)