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

Systemtic Name: 8-[1-(4-tert-butylphenoxy)-2-methyl-propan-2-yl]-3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]purin-6-amine Openeye Name: 8-[2-(4-tert-butylphenoxy)-1,1-dimethyl-ethyl]-3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]purin-6-amine CAS Name: 8-[1-(4-tert-butylphenoxy)-2-methylpropan-2-yl]-3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-6-purinamine IUPAC Name: 8-[1-(4-tert-butylphenoxy)-2-methylpropan-2-yl]-3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]purin-6-amine Traditional Name: [8-[2-(4-tert-butylphenoxy)-1,1-dimethyl-ethyl]-3-[3-(cyclopentoxy)-4-methoxy-benzyl]purin-6-yl]amine Formula: C32H41N5O3 MolecularWeight: 543.69964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H41N5O3/c1-31(2,3)22-12-14-23(15-13-22)39-19-32(4,5)30-35-27-28(33)34-20-37(29(27)36-30)18-21-11-16-25(38-6)26(17-21)40-24-9-7-8-10-24/h11-17,20,24H,7-10,18-19,33H2,1-6H3