2-chloranyl-9-cyclopentyl-N-[2-(trifluoromethyloxy)phenyl]purin-6-amine

Systemtic Name: 2-chloranyl-9-cyclopentyl-N-[2-(trifluoromethyloxy)phenyl]purin-6-amine Openeye Name: 2-chloro-9-cyclopentyl-N-[2-(trifluoromethoxy)phenyl]purin-6-amine CAS Name: 2-chloro-9-cyclopentyl-N-[2-(trifluoromethoxy)phenyl]-6-purinamine IUPAC Name: 2-chloro-9-cyclopentyl-N-[2-(trifluoromethoxy)phenyl]purin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-[2-(trifluoromethoxy)phenyl]amine Formula: C17H15ClF3N5O MolecularWeight: 397.78211

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4=CC=CC=C4OC(F)(F)F)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4=CC=CC=C4OC(F)(F)F)Cl

InChI

InChI=1S/C17H15ClF3N5O/c18-16-24-14(23-11-7-3-4-8-12(11)27-17(19,20)21)13-15(25-16)26(9-22-13)10-5-1-2-6-10/h3-4,7-10H,1-2,5-6H2,(H,23,24,25)