3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-[2-[[4-(trifluoromethyloxy)phenyl]methoxy]propan-2-yl]purin-6-amine

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-[2-[[4-(trifluoromethyloxy)phenyl]methoxy]propan-2-yl]purin-6-amine Openeye Name: 3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-8-[1-methyl-1-[[4-(trifluoromethoxy)phenyl]methoxy]ethyl]purin-6-amine CAS Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[[4-(trifluoromethoxy)phenyl]methoxy]propan-2-yl]-6-purinamine IUPAC Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[[4-(trifluoromethoxy)phenyl]methoxy]propan-2-yl]purin-6-amine Traditional Name: [3-[3-(cyclopentoxy)-4-methoxy-benzyl]-8-[1-methyl-1-[4-(trifluoromethoxy)benzyl]oxy-ethyl]purin-6-yl]amine Formula: C29H32F3N5O4 MolecularWeight: 571.59069

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=NC2=C(N=CN(C2=N1)CC3=CC(=C(C=C3)OC)OC4CCCC4)N)OCC5=CC=C(C=C5)OC(F)(F)F

Isomeric SMILES

CC(C)(C1=NC2=C(N=CN(C2=N1)CC3=CC(=C(C=C3)OC)OC4CCCC4)N)OCC5=CC=C(C=C5)OC(F)(F)F

InChI

InChI=1S/C29H32F3N5O4/c1-28(2,39-16-18-8-11-21(12-9-18)41-29(30,31)32)27-35-24-25(33)34-17-37(26(24)36-27)15-19-10-13-22(38-3)23(14-19)40-20-6-4-5-7-20/h8-14,17,20H,4-7,15-16,33H2,1-3H3