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

Systemtic Name: 1-phenyl-2-[[9-propan-2-yl-6-[[3-(trifluoromethyl)phenyl]methylamino]purin-2-yl]amino]ethanol Openeye Name: 2-[[9-isopropyl-6-[[3-(trifluoromethyl)phenyl]methylamino]purin-2-yl]amino]-1-phenyl-ethanol CAS Name: 1-phenyl-2-[[9-propan-2-yl-6-[[3-(trifluoromethyl)phenyl]methylamino]-2-purinyl]amino]ethanol IUPAC Name: 1-phenyl-2-[[9-propan-2-yl-6-[[3-(trifluoromethyl)phenyl]methylamino]purin-2-yl]amino]ethanol Traditional Name: 2-[[9-isopropyl-6-[[3-(trifluoromethyl)benzyl]amino]purin-2-yl]amino]-1-phenyl-ethanol Formula: C24H25F3N6O MolecularWeight: 470.49011

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC(=CC=C3)C(F)(F)F)NCC(C4=CC=CC=C4)O

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC(=CC=C3)C(F)(F)F)NCC(C4=CC=CC=C4)O

InChI

InChI=1S/C24H25F3N6O/c1-15(2)33-14-30-20-21(28-12-16-7-6-10-18(11-16)24(25,26)27)31-23(32-22(20)33)29-13-19(34)17-8-4-3-5-9-17/h3-11,14-15,19,34H,12-13H2,1-2H3,(H2,28,29,31,32)