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

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-[1-[(3-fluorophenyl)methoxy]propan-2-yl]purin-6-amine Openeye Name: 3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-8-[2-[(3-fluorophenyl)methoxy]-1-methyl-ethyl]purin-6-amine CAS Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[1-[(3-fluorophenyl)methoxy]propan-2-yl]-6-purinamine IUPAC Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[1-[(3-fluorophenyl)methoxy]propan-2-yl]purin-6-amine Traditional Name: [3-[3-(cyclopentoxy)-4-methoxy-benzyl]-8-[2-(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(COCC1=CC(=CC=C1)F)C2=NC3=C(N=CN(C3=N2)CC4=CC(=C(C=C4)OC)OC5CCCC5)N

Isomeric SMILES

CC(COCC1=CC(=CC=C1)F)C2=NC3=C(N=CN(C3=N2)CC4=CC(=C(C=C4)OC)OC5CCCC5)N

InChI

InChI=1S/C28H32FN5O3/c1-18(15-36-16-20-6-5-7-21(29)12-20)27-32-25-26(30)31-17-34(28(25)33-27)14-19-10-11-23(35-2)24(13-19)37-22-8-3-4-9-22/h5-7,10-13,17-18,22H,3-4,8-9,14-16,30H2,1-2H3