9-[(4-fluorophenyl)methyl]-N2-(phenylmethyl)purine-2,6-diamine

Systemtic Name: 9-[(4-fluorophenyl)methyl]-N2-(phenylmethyl)purine-2,6-diamine Openeye Name: N2-benzyl-9-[(4-fluorophenyl)methyl]purine-2,6-diamine CAS Name: 9-[(4-fluorophenyl)methyl]-N2-(phenylmethyl)purine-2,6-diamine IUPAC Name: 2-N-benzyl-9-[(4-fluorophenyl)methyl]purine-2,6-diamine Traditional Name: [6-amino-9-(4-fluorobenzyl)purin-2-yl]-benzyl-amine Formula: C19H17FN6 MolecularWeight: 348.376883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC3=C(C(=N2)N)N=CN3CC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC3=C(C(=N2)N)N=CN3CC4=CC=C(C=C4)F

InChI

InChI=1S/C19H17FN6/c20-15-8-6-14(7-9-15)11-26-12-23-16-17(21)24-19(25-18(16)26)22-10-13-4-2-1-3-5-13/h1-9,12H,10-11H2,(H3,21,22,24,25)