9-methyl-N-phenethyl-6-(trifluoromethyl)purin-2-amine

Systemtic Name: 9-methyl-N-phenethyl-6-(trifluoromethyl)purin-2-amine Openeye Name: 9-methyl-N-phenethyl-6-(trifluoromethyl)purin-2-amine CAS Name: 9-methyl-N-phenethyl-6-(trifluoromethyl)-2-purinamine IUPAC Name: 9-methyl-N-phenethyl-6-(trifluoromethyl)purin-2-amine Traditional Name: [9-methyl-6-(trifluoromethyl)purin-2-yl]-phenethyl-amine Formula: C15H14F3N5 MolecularWeight: 321.30037

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C(N=C(N=C21)NCCC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CN1C=NC2=C(N=C(N=C21)NCCC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C15H14F3N5/c1-23-9-20-11-12(15(16,17)18)21-14(22-13(11)23)19-8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,19,21,22)