9-(2-fluoranylpropyl)-N2-(3-phenylpropyl)purine-2,6-diamine

Systemtic Name: 9-(2-fluoranylpropyl)-N2-(3-phenylpropyl)purine-2,6-diamine Openeye Name: 9-(2-fluoropropyl)-N2-(3-phenylpropyl)purine-2,6-diamine CAS Name: 9-(2-fluoropropyl)-N2-(3-phenylpropyl)purine-2,6-diamine IUPAC Name: 9-(2-fluoropropyl)-2-N-(3-phenylpropyl)purine-2,6-diamine Traditional Name: [6-amino-9-(2-fluoropropyl)purin-2-yl]-(3-phenylpropyl)amine Formula: C17H21FN6 MolecularWeight: 328.387243

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC2=C1N=C(N=C2N)NCCCC3=CC=CC=C3)F

Isomeric SMILES

CC(CN1C=NC2=C1N=C(N=C2N)NCCCC3=CC=CC=C3)F

InChI

InChI=1S/C17H21FN6/c1-12(18)10-24-11-21-14-15(19)22-17(23-16(14)24)20-9-5-8-13-6-3-2-4-7-13/h2-4,6-7,11-12H,5,8-10H2,1H3,(H3,19,20,22,23)