6-[2-chloranyl-4-(trifluoromethyl)phenyl]-9-(dicyclopropylmethyl)-8-methoxy-purine

Systemtic Name: 6-[2-chloranyl-4-(trifluoromethyl)phenyl]-9-(dicyclopropylmethyl)-8-methoxy-purine Openeye Name: 6-[2-chloro-4-(trifluoromethyl)phenyl]-9-(dicyclopropylmethyl)-8-methoxy-purine CAS Name: 6-[2-chloro-4-(trifluoromethyl)phenyl]-9-(dicyclopropylmethyl)-8-methoxypurine IUPAC Name: 6-[2-chloro-4-(trifluoromethyl)phenyl]-9-(dicyclopropylmethyl)-8-methoxypurine Traditional Name: 6-[2-chloro-4-(trifluoromethyl)phenyl]-9-(dicyclopropylmethyl)-8-methoxy-purine Formula: C20H18ClF3N4O MolecularWeight: 422.83133

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(N=CN=C2N1C(C3CC3)C4CC4)C5=C(C=C(C=C5)C(F)(F)F)Cl

Isomeric SMILES

COC1=NC2=C(N=CN=C2N1C(C3CC3)C4CC4)C5=C(C=C(C=C5)C(F)(F)F)Cl

InChI

InChI=1S/C20H18ClF3N4O/c1-29-19-27-16-15(13-7-6-12(8-14(13)21)20(22,23)24)25-9-26-18(16)28(19)17(10-2-3-10)11-4-5-11/h6-11,17H,2-5H2,1H3