9-(2-chloranylpyrimidin-4-yl)-N-ethyl-2-(trifluoromethyl)purin-6-amine

Systemtic Name: 9-(2-chloranylpyrimidin-4-yl)-N-ethyl-2-(trifluoromethyl)purin-6-amine Openeye Name: 9-(2-chloropyrimidin-4-yl)-N-ethyl-2-(trifluoromethyl)purin-6-amine CAS Name: 9-(2-chloro-4-pyrimidinyl)-N-ethyl-2-(trifluoromethyl)-6-purinamine IUPAC Name: 9-(2-chloropyrimidin-4-yl)-N-ethyl-2-(trifluoromethyl)purin-6-amine Traditional Name: [9-(2-chloropyrimidin-4-yl)-2-(trifluoromethyl)purin-6-yl]-ethyl-amine Formula: C12H9ClF3N7 MolecularWeight: 343.69497

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=C1N=CN2C3=NC(=NC=C3)Cl)C(F)(F)F

Isomeric SMILES

CCNC1=NC(=NC2=C1N=CN2C3=NC(=NC=C3)Cl)C(F)(F)F

InChI

InChI=1S/C12H9ClF3N7/c1-2-17-8-7-9(22-10(21-8)12(14,15)16)23(5-19-7)6-3-4-18-11(13)20-6/h3-5H,2H2,1H3,(H,17,21,22)