2-[1-azanyl-2-(3-fluorophenyl)ethyl]-9-propyl-8-pyrazol-1-yl-purin-6-amine

Systemtic Name: 2-[1-azanyl-2-(3-fluorophenyl)ethyl]-9-propyl-8-pyrazol-1-yl-purin-6-amine Openeye Name: 2-[1-amino-2-(3-fluorophenyl)ethyl]-9-propyl-8-pyrazol-1-yl-purin-6-amine CAS Name: 2-[1-amino-2-(3-fluorophenyl)ethyl]-9-propyl-8-(1-pyrazolyl)-6-purinamine IUPAC Name: 2-[1-amino-2-(3-fluorophenyl)ethyl]-9-propyl-8-pyrazol-1-ylpurin-6-amine Traditional Name: [2-[1-amino-2-(3-fluorophenyl)ethyl]-9-propyl-8-pyrazol-1-yl-purin-6-yl]amine Formula: C19H21FN8 MolecularWeight: 380.422043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C(CC3=CC(=CC=C3)F)N)N)N=C1N4C=CC=N4

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C(CC3=CC(=CC=C3)F)N)N)N=C1N4C=CC=N4

InChI

InChI=1S/C19H21FN8/c1-2-8-27-18-15(24-19(27)28-9-4-7-23-28)16(22)25-17(26-18)14(21)11-12-5-3-6-13(20)10-12/h3-7,9-10,14H,2,8,11,21H2,1H3,(H2,22,25,26)