1-[6-azanyl-8-(3-fluorophenyl)-9-propyl-purin-2-yl]-2-methyl-butan-2-ol

Systemtic Name: 1-[6-azanyl-8-(3-fluorophenyl)-9-propyl-purin-2-yl]-2-methyl-butan-2-ol Openeye Name: 1-[6-amino-8-(3-fluorophenyl)-9-propyl-purin-2-yl]-2-methyl-butan-2-ol CAS Name: 1-[6-amino-8-(3-fluorophenyl)-9-propyl-2-purinyl]-2-methyl-2-butanol IUPAC Name: 1-[6-amino-8-(3-fluorophenyl)-9-propylpurin-2-yl]-2-methylbutan-2-ol Traditional Name: 1-[6-amino-8-(3-fluorophenyl)-9-propyl-purin-2-yl]-2-methyl-butan-2-ol Formula: C19H24FN5O MolecularWeight: 357.425163

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)CC(C)(CC)O)N)N=C1C3=CC(=CC=C3)F

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)CC(C)(CC)O)N)N=C1C3=CC(=CC=C3)F

InChI

InChI=1S/C19H24FN5O/c1-4-9-25-17(12-7-6-8-13(20)10-12)24-15-16(21)22-14(23-18(15)25)11-19(3,26)5-2/h6-8,10,26H,4-5,9,11H2,1-3H3,(H2,21,22,23)