3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-[1-[(3-fluorophenyl)methoxy]ethyl]purin-6-amine

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-[1-[(3-fluorophenyl)methoxy]ethyl]purin-6-amine Openeye Name: 3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-8-[1-[(3-fluorophenyl)methoxy]ethyl]purin-6-amine CAS Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[1-[(3-fluorophenyl)methoxy]ethyl]-6-purinamine IUPAC Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[1-[(3-fluorophenyl)methoxy]ethyl]purin-6-amine Traditional Name: [3-[3-(cyclopentoxy)-4-methoxy-benzyl]-8-[1-(3-fluorobenzyl)oxyethyl]purin-6-yl]amine Formula: C27H30FN5O3 MolecularWeight: 491.557203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30FN5O3/c1-17(35-15-19-6-5-7-20(28)12-19)26-31-24-25(29)30-16-33(27(24)32-26)14-18-10-11-22(34-2)23(13-18)36-21-8-3-4-9-21/h5-7,10-13,16-17,21H,3-4,8-9,14-15,29H2,1-2H3