2-chloranyl-6-[2-methyl-4-(trifluoromethyl)phenyl]-7H-purine

Systemtic Name: 2-chloranyl-6-[2-methyl-4-(trifluoromethyl)phenyl]-7H-purine Openeye Name: 2-chloro-6-[2-methyl-4-(trifluoromethyl)phenyl]-7H-purine CAS Name: 2-chloro-6-[2-methyl-4-(trifluoromethyl)phenyl]-7H-purine IUPAC Name: 2-chloro-6-[2-methyl-4-(trifluoromethyl)phenyl]-7H-purine Traditional Name: 2-chloro-6-[2-methyl-4-(trifluoromethyl)phenyl]-7H-purine Formula: C13H8ClF3N4 MolecularWeight: 312.67763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(F)(F)F)C2=C3C(=NC(=N2)Cl)N=CN3

Isomeric SMILES

CC1=C(C=CC(=C1)C(F)(F)F)C2=C3C(=NC(=N2)Cl)N=CN3

InChI

InChI=1S/C13H8ClF3N4/c1-6-4-7(13(15,16)17)2-3-8(6)9-10-11(19-5-18-10)21-12(14)20-9/h2-5H,1H3,(H,18,19,20,21)