N-cyclopropyl-9-[(4-fluorophenyl)methyl]-2-(trifluoromethyl)purin-6-amine

Systemtic Name: N-cyclopropyl-9-[(4-fluorophenyl)methyl]-2-(trifluoromethyl)purin-6-amine Openeye Name: N-cyclopropyl-9-[(4-fluorophenyl)methyl]-2-(trifluoromethyl)purin-6-amine CAS Name: N-cyclopropyl-9-[(4-fluorophenyl)methyl]-2-(trifluoromethyl)-6-purinamine IUPAC Name: N-cyclopropyl-9-[(4-fluorophenyl)methyl]-2-(trifluoromethyl)purin-6-amine Traditional Name: cyclopropyl-[9-(4-fluorobenzyl)-2-(trifluoromethyl)purin-6-yl]amine Formula: C16H13F4N5 MolecularWeight: 351.301533

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC3=C2N=CN3CC4=CC=C(C=C4)F)C(F)(F)F

Isomeric SMILES

C1CC1NC2=NC(=NC3=C2N=CN3CC4=CC=C(C=C4)F)C(F)(F)F

InChI

InChI=1S/C16H13F4N5/c17-10-3-1-9(2-4-10)7-25-8-21-12-13(22-11-5-6-11)23-15(16(18,19)20)24-14(12)25/h1-4,8,11H,5-7H2,(H,22,23,24)