2-[[9-propan-2-yl-6-[[2-(trifluoromethyl)phenyl]amino]purin-2-yl]amino]ethanol

Systemtic Name: 2-[[9-propan-2-yl-6-[[2-(trifluoromethyl)phenyl]amino]purin-2-yl]amino]ethanol Openeye Name: 2-[[9-isopropyl-6-[2-(trifluoromethyl)anilino]purin-2-yl]amino]ethanol CAS Name: 2-[[9-propan-2-yl-6-[2-(trifluoromethyl)anilino]-2-purinyl]amino]ethanol IUPAC Name: 2-[[9-propan-2-yl-6-[2-(trifluoromethyl)anilino]purin-2-yl]amino]ethanol Traditional Name: 2-[[9-isopropyl-6-[2-(trifluoromethyl)anilino]purin-2-yl]amino]ethanol Formula: C17H19F3N6O MolecularWeight: 380.36757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC=CC=C3C(F)(F)F)NCCO

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC=CC=C3C(F)(F)F)NCCO

InChI

InChI=1S/C17H19F3N6O/c1-10(2)26-9-22-13-14(24-16(21-7-8-27)25-15(13)26)23-12-6-4-3-5-11(12)17(18,19)20/h3-6,9-10,27H,7-8H2,1-2H3,(H2,21,23,24,25)