N-methyl-N-phenyl-2-[2-[4-(trifluoromethyl)phenyl]purin-9-yl]ethanamide

Systemtic Name: N-methyl-N-phenyl-2-[2-[4-(trifluoromethyl)phenyl]purin-9-yl]ethanamide Openeye Name: N-methyl-N-phenyl-2-[2-[4-(trifluoromethyl)phenyl]purin-9-yl]acetamide CAS Name: N-methyl-N-phenyl-2-[2-[4-(trifluoromethyl)phenyl]-9-purinyl]acetamide IUPAC Name: N-methyl-N-phenyl-2-[2-[4-(trifluoromethyl)phenyl]purin-9-yl]acetamide Traditional Name: N-methyl-N-phenyl-2-[2-[4-(trifluoromethyl)phenyl]purin-9-yl]acetamide Formula: C21H16F3N5O MolecularWeight: 411.37985

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CN2C=NC3=CN=C(N=C32)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CN2C=NC3=CN=C(N=C32)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H16F3N5O/c1-28(16-5-3-2-4-6-16)18(30)12-29-13-26-17-11-25-19(27-20(17)29)14-7-9-15(10-8-14)21(22,23)24/h2-11,13H,12H2,1H3