2-(2-cyclopentylethynyl)-8-(3-fluorophenyl)-9-methyl-purin-6-amine

Systemtic Name: 2-(2-cyclopentylethynyl)-8-(3-fluorophenyl)-9-methyl-purin-6-amine Openeye Name: 2-(2-cyclopentylethynyl)-8-(3-fluorophenyl)-9-methyl-purin-6-amine CAS Name: 2-(2-cyclopentylethynyl)-8-(3-fluorophenyl)-9-methyl-6-purinamine IUPAC Name: 2-(2-cyclopentylethynyl)-8-(3-fluorophenyl)-9-methylpurin-6-amine Traditional Name: [2-(2-cyclopentylethynyl)-8-(3-fluorophenyl)-9-methyl-purin-6-yl]amine Formula: C19H18FN5 MolecularWeight: 335.378123

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC(=N2)C#CC3CCCC3)N)N=C1C4=CC(=CC=C4)F

Isomeric SMILES

CN1C2=C(C(=NC(=N2)C#CC3CCCC3)N)N=C1C4=CC(=CC=C4)F

InChI

InChI=1S/C19H18FN5/c1-25-18(13-7-4-8-14(20)11-13)24-16-17(21)22-15(23-19(16)25)10-9-12-5-2-3-6-12/h4,7-8,11-12H,2-3,5-6H2,1H3,(H2,21,22,23)