9-butyl-6-(3-ethoxypropoxy)-N-(4-fluorophenyl)purin-2-amine

Systemtic Name: 9-butyl-6-(3-ethoxypropoxy)-N-(4-fluorophenyl)purin-2-amine Openeye Name: 9-butyl-6-(3-ethoxypropoxy)-N-(4-fluorophenyl)purin-2-amine CAS Name: 9-butyl-6-(3-ethoxypropoxy)-N-(4-fluorophenyl)-2-purinamine IUPAC Name: 9-butyl-6-(3-ethoxypropoxy)-N-(4-fluorophenyl)purin-2-amine Traditional Name: [9-butyl-6-(3-ethoxypropoxy)purin-2-yl]-(4-fluorophenyl)amine Formula: C20H26FN5O2 MolecularWeight: 387.451143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C1N=C(N=C2OCCCOCC)NC3=CC=C(C=C3)F

Isomeric SMILES

CCCCN1C=NC2=C1N=C(N=C2OCCCOCC)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H26FN5O2/c1-3-5-11-26-14-22-17-18(26)24-20(23-16-9-7-15(21)8-10-16)25-19(17)28-13-6-12-27-4-2/h7-10,14H,3-6,11-13H2,1-2H3,(H,23,24,25)