2-(4-fluorophenyl)-N-[(4-methoxyphenyl)methyl]-9-propan-2-yl-purin-6-amine

Systemtic Name: 2-(4-fluorophenyl)-N-[(4-methoxyphenyl)methyl]-9-propan-2-yl-purin-6-amine Openeye Name: 2-(4-fluorophenyl)-9-isopropyl-N-[(4-methoxyphenyl)methyl]purin-6-amine CAS Name: 2-(4-fluorophenyl)-N-[(4-methoxyphenyl)methyl]-9-propan-2-yl-6-purinamine IUPAC Name: 2-(4-fluorophenyl)-N-[(4-methoxyphenyl)methyl]-9-propan-2-ylpurin-6-amine Traditional Name: [2-(4-fluorophenyl)-9-isopropyl-purin-6-yl]-p-anisyl-amine Formula: C22H22FN5O MolecularWeight: 391.441383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN5O/c1-14(2)28-13-25-19-21(24-12-15-4-10-18(29-3)11-5-15)26-20(27-22(19)28)16-6-8-17(23)9-7-16/h4-11,13-14H,12H2,1-3H3,(H,24,26,27)