N2-[2-(4-fluorophenyl)ethyl]-9-propyl-8-pyrazol-1-yl-purine-2,6-diamine

Systemtic Name: N2-[2-(4-fluorophenyl)ethyl]-9-propyl-8-pyrazol-1-yl-purine-2,6-diamine Openeye Name: N2-[2-(4-fluorophenyl)ethyl]-9-propyl-8-pyrazol-1-yl-purine-2,6-diamine CAS Name: N2-[2-(4-fluorophenyl)ethyl]-9-propyl-8-(1-pyrazolyl)purine-2,6-diamine IUPAC Name: 2-N-[2-(4-fluorophenyl)ethyl]-9-propyl-8-pyrazol-1-ylpurine-2,6-diamine Traditional Name: (6-amino-9-propyl-8-pyrazol-1-yl-purin-2-yl)-[2-(4-fluorophenyl)ethyl]amine Formula: C19H21FN8 MolecularWeight: 380.422043

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)NCCC3=CC=C(C=C3)F)N)N=C1N4C=CC=N4

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)NCCC3=CC=C(C=C3)F)N)N=C1N4C=CC=N4

InChI

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