9-(2,4-dimethoxypyrimidin-5-yl)-N-methyl-2-(trifluoromethyl)purin-6-amine

Systemtic Name: 9-(2,4-dimethoxypyrimidin-5-yl)-N-methyl-2-(trifluoromethyl)purin-6-amine Openeye Name: 9-(2,4-dimethoxypyrimidin-5-yl)-N-methyl-2-(trifluoromethyl)purin-6-amine CAS Name: 9-(2,4-dimethoxy-5-pyrimidinyl)-N-methyl-2-(trifluoromethyl)-6-purinamine IUPAC Name: 9-(2,4-dimethoxypyrimidin-5-yl)-N-methyl-2-(trifluoromethyl)purin-6-amine Traditional Name: [9-(2,4-dimethoxypyrimidin-5-yl)-2-(trifluoromethyl)purin-6-yl]-methyl-amine Formula: C13H12F3N7O2 MolecularWeight: 355.27529

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1N=CN2C3=CN=C(N=C3OC)OC)C(F)(F)F

Isomeric SMILES

CNC1=NC(=NC2=C1N=CN2C3=CN=C(N=C3OC)OC)C(F)(F)F

InChI

InChI=1S/C13H12F3N7O2/c1-17-8-7-9(21-11(20-8)13(14,15)16)23(5-19-7)6-4-18-12(25-3)22-10(6)24-2/h4-5H,1-3H3,(H,17,20,21)