2-chloranyl-8-methyl-N-[1,1,1-tris(fluoranyl)propan-2-yl]-7H-purin-6-amine

Systemtic Name: 2-chloranyl-8-methyl-N-[1,1,1-tris(fluoranyl)propan-2-yl]-7H-purin-6-amine Openeye Name: 2-chloro-8-methyl-N-(2,2,2-trifluoro-1-methyl-ethyl)-7H-purin-6-amine CAS Name: 2-chloro-8-methyl-N-(1,1,1-trifluoropropan-2-yl)-7H-purin-6-amine IUPAC Name: 2-chloro-8-methyl-N-(1,1,1-trifluoropropan-2-yl)-7H-purin-6-amine Traditional Name: (2-chloro-8-methyl-7H-purin-6-yl)-(2,2,2-trifluoro-1-methyl-ethyl)amine Formula: C9H9ClF3N5 MolecularWeight: 279.64947

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1)C(=NC(=N2)Cl)NC(C)C(F)(F)F

Isomeric SMILES

CC1=NC2=C(N1)C(=NC(=N2)Cl)NC(C)C(F)(F)F

InChI

InChI=1S/C9H9ClF3N5/c1-3(9(11,12)13)14-6-5-7(16-4(2)15-5)18-8(10)17-6/h3H,1-2H3,(H2,14,15,16,17,18)