9-[(2-fluorophenyl)methyl]-N-methyl-2-phenyl-purin-6-amine; methanesulfonic acid

Systemtic Name: 9-[(2-fluorophenyl)methyl]-N-methyl-2-phenyl-purin-6-amine; methanesulfonic acid Openeye Name: 9-[(2-fluorophenyl)methyl]-N-methyl-2-phenyl-purin-6-amine; methanesulfonic acid CAS Name: 9-[(2-fluorophenyl)methyl]-N-methyl-2-phenyl-6-purinamine; methanesulfonic acid IUPAC Name: 9-[(2-fluorophenyl)methyl]-N-methyl-2-phenylpurin-6-amine; methanesulfonic acid Traditional Name: [9-(2-fluorobenzyl)-2-phenyl-purin-6-yl]-methyl-amine; mesylic acid Formula: C20H20FN5O3S MolecularWeight: 429.467903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1N=CN2CC3=CC=CC=C3F)C4=CC=CC=C4.CS(=O)(=O)O

Isomeric SMILES

CNC1=NC(=NC2=C1N=CN2CC3=CC=CC=C3F)C4=CC=CC=C4.CS(=O)(=O)O

InChI

InChI=1S/C19H16FN5.CH4O3S/c1-21-18-16-19(24-17(23-18)13-7-3-2-4-8-13)25(12-22-16)11-14-9-5-6-10-15(14)20;1-5(2,3)4/h2-10,12H,11H2,1H3,(H,21,23,24);1H3,(H,2,3,4)