8-methoxy-9-methyl-N-[3-(trifluoromethyl)phenyl]purin-6-amine

Systemtic Name: 8-methoxy-9-methyl-N-[3-(trifluoromethyl)phenyl]purin-6-amine Openeye Name: 8-methoxy-9-methyl-N-[3-(trifluoromethyl)phenyl]purin-6-amine CAS Name: 8-methoxy-9-methyl-N-[3-(trifluoromethyl)phenyl]-6-purinamine IUPAC Name: 8-methoxy-9-methyl-N-[3-(trifluoromethyl)phenyl]purin-6-amine Traditional Name: (8-methoxy-9-methyl-purin-6-yl)-[3-(trifluoromethyl)phenyl]amine Formula: C14H12F3N5O MolecularWeight: 323.27319

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC=N2)NC3=CC=CC(=C3)C(F)(F)F)N=C1OC

Isomeric SMILES

CN1C2=C(C(=NC=N2)NC3=CC=CC(=C3)C(F)(F)F)N=C1OC

InChI

InChI=1S/C14H12F3N5O/c1-22-12-10(21-13(22)23-2)11(18-7-19-12)20-9-5-3-4-8(6-9)14(15,16)17/h3-7H,1-2H3,(H,18,19,20)