[3-[6-ethyl-2-(trifluoromethyl)purin-9-yl]phenyl]methanamine

Systemtic Name: [3-[6-ethyl-2-(trifluoromethyl)purin-9-yl]phenyl]methanamine Openeye Name: [3-[6-ethyl-2-(trifluoromethyl)purin-9-yl]phenyl]methanamine CAS Name: [3-[6-ethyl-2-(trifluoromethyl)-9-purinyl]phenyl]methanamine IUPAC Name: [3-[6-ethyl-2-(trifluoromethyl)purin-9-yl]phenyl]methanamine Traditional Name: [3-[6-ethyl-2-(trifluoromethyl)purin-9-yl]benzyl]amine Formula: C15H14F3N5 MolecularWeight: 321.30037

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NC(=N1)C(F)(F)F)N(C=N2)C3=CC=CC(=C3)CN

Isomeric SMILES

CCC1=C2C(=NC(=N1)C(F)(F)F)N(C=N2)C3=CC=CC(=C3)CN

InChI

InChI=1S/C15H14F3N5/c1-2-11-12-13(22-14(21-11)15(16,17)18)23(8-20-12)10-5-3-4-9(6-10)7-19/h3-6,8H,2,7,19H2,1H3