3-[[9-ethyl-6-[[3-(trifluoromethyl)phenyl]amino]purin-2-yl]amino]propan-1-ol

Systemtic Name: 3-[[9-ethyl-6-[[3-(trifluoromethyl)phenyl]amino]purin-2-yl]amino]propan-1-ol Openeye Name: 3-[[9-ethyl-6-[3-(trifluoromethyl)anilino]purin-2-yl]amino]propan-1-ol CAS Name: 3-[[9-ethyl-6-[3-(trifluoromethyl)anilino]-2-purinyl]amino]-1-propanol IUPAC Name: 3-[[9-ethyl-6-[3-(trifluoromethyl)anilino]purin-2-yl]amino]propan-1-ol Traditional Name: 3-[[9-ethyl-6-[3-(trifluoromethyl)anilino]purin-2-yl]amino]propan-1-ol Formula: C17H19F3N6O MolecularWeight: 380.36757

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC=CC(=C3)C(F)(F)F)NCCCO

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC=CC(=C3)C(F)(F)F)NCCCO

InChI

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