N-phenyl-2-(trifluoromethyl)-7H-purin-6-amine

Systemtic Name: N-phenyl-2-(trifluoromethyl)-7H-purin-6-amine Openeye Name: N-phenyl-2-(trifluoromethyl)-7H-purin-6-amine CAS Name: N-phenyl-2-(trifluoromethyl)-7H-purin-6-amine IUPAC Name: N-phenyl-2-(trifluoromethyl)-7H-purin-6-amine Traditional Name: phenyl-[2-(trifluoromethyl)-7H-purin-6-yl]amine Formula: C12H8F3N5 MolecularWeight: 279.22063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC3=C2NC=N3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC3=C2NC=N3)C(F)(F)F

InChI

InChI=1S/C12H8F3N5/c13-12(14,15)11-19-9-8(16-6-17-9)10(20-11)18-7-4-2-1-3-5-7/h1-6H,(H2,16,17,18,19,20)