3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-[1-(2-fluoranylphenoxy)-2-methyl-propan-2-yl]purin-6-amine

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC1=CC=CC=C1F)C2=NC3=C(N=CN(C3=N2)CC4=CC(=C(C=C4)OC)OC5CCCC5)N

Isomeric SMILES

CC(C)(COC1=CC=CC=C1F)C2=NC3=C(N=CN(C3=N2)CC4=CC(=C(C=C4)OC)OC5CCCC5)N

InChI

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