N2-(4-azanylbutyl)-9-ethyl-N6-(4-fluorophenyl)purine-2,6-diamine

Systemtic Name: N2-(4-azanylbutyl)-9-ethyl-N6-(4-fluorophenyl)purine-2,6-diamine Openeye Name: N2-(4-aminobutyl)-9-ethyl-N6-(4-fluorophenyl)purine-2,6-diamine CAS Name: N2-(4-aminobutyl)-9-ethyl-N6-(4-fluorophenyl)purine-2,6-diamine IUPAC Name: 2-N-(4-aminobutyl)-9-ethyl-6-N-(4-fluorophenyl)purine-2,6-diamine Traditional Name: 4-aminobutyl-[9-ethyl-6-(4-fluoroanilino)purin-2-yl]amine Formula: C17H22FN7 MolecularWeight: 343.401883

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC=C(C=C3)F)NCCCCN

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC=C(C=C3)F)NCCCCN

InChI

InChI=1S/C17H22FN7/c1-2-25-11-21-14-15(22-13-7-5-12(18)6-8-13)23-17(24-16(14)25)20-10-4-3-9-19/h5-8,11H,2-4,9-10,19H2,1H3,(H2,20,22,23,24)