9-methyl-6-phenylmethoxy-8-(trifluoromethyl)purin-2-amine

Systemtic Name: 9-methyl-6-phenylmethoxy-8-(trifluoromethyl)purin-2-amine Openeye Name: 6-benzyloxy-9-methyl-8-(trifluoromethyl)purin-2-amine CAS Name: 9-methyl-6-phenylmethoxy-8-(trifluoromethyl)-2-purinamine IUPAC Name: 9-methyl-6-phenylmethoxy-8-(trifluoromethyl)purin-2-amine Traditional Name: [6-benzoxy-9-methyl-8-(trifluoromethyl)purin-2-yl]amine Formula: C14H12F3N5O MolecularWeight: 323.27319

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC(=N2)N)OCC3=CC=CC=C3)N=C1C(F)(F)F

Isomeric SMILES

CN1C2=C(C(=NC(=N2)N)OCC3=CC=CC=C3)N=C1C(F)(F)F

InChI

InChI=1S/C14H12F3N5O/c1-22-10-9(19-12(22)14(15,16)17)11(21-13(18)20-10)23-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,18,20,21)