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

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-[2-[(3-fluorophenyl)methoxy]propan-2-yl]purin-6-amine Openeye Name: 3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-8-[1-[(3-fluorophenyl)methoxy]-1-methyl-ethyl]purin-6-amine CAS Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(3-fluorophenyl)methoxy]propan-2-yl]-6-purinamine IUPAC Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(3-fluorophenyl)methoxy]propan-2-yl]purin-6-amine Traditional Name: [3-[3-(cyclopentoxy)-4-methoxy-benzyl]-8-[1-(3-fluorobenzyl)oxy-1-methyl-ethyl]purin-6-yl]amine Formula: C28H32FN5O3 MolecularWeight: 505.583783

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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(=CC=C5)F

Isomeric SMILES

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

InChI

InChI=1S/C28H32FN5O3/c1-28(2,36-16-19-7-6-8-20(29)13-19)27-32-24-25(30)31-17-34(26(24)33-27)15-18-11-12-22(35-3)23(14-18)37-21-9-4-5-10-21/h6-8,11-14,17,21H,4-5,9-10,15-16,30H2,1-3H3