N-(3-chlorophenyl)-8-(trifluoromethyl)-7H-purin-6-amine

Systemtic Name: N-(3-chlorophenyl)-8-(trifluoromethyl)-7H-purin-6-amine Openeye Name: N-(3-chlorophenyl)-8-(trifluoromethyl)-7H-purin-6-amine CAS Name: N-(3-chlorophenyl)-8-(trifluoromethyl)-7H-purin-6-amine IUPAC Name: N-(3-chlorophenyl)-8-(trifluoromethyl)-7H-purin-6-amine Traditional Name: (3-chlorophenyl)-[8-(trifluoromethyl)-7H-purin-6-yl]amine Formula: C12H7ClF3N5 MolecularWeight: 313.66569

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H7ClF3N5/c13-6-2-1-3-7(4-6)19-9-8-10(18-5-17-9)21-11(20-8)12(14,15)16/h1-5H,(H2,17,18,19,20,21)