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

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-[2-methyl-1-(2-thiophen-2-ylphenoxy)propan-2-yl]purin-6-amine Openeye Name: 3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-8-[1,1-dimethyl-2-[2-(2-thienyl)phenoxy]ethyl]purin-6-amine CAS Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-methyl-1-(2-thiophen-2-ylphenoxy)propan-2-yl]-6-purinamine IUPAC Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-methyl-1-(2-thiophen-2-ylphenoxy)propan-2-yl]purin-6-amine Traditional Name: [3-[3-(cyclopentoxy)-4-methoxy-benzyl]-8-[1,1-dimethyl-2-[2-(2-thienyl)phenoxy]ethyl]purin-6-yl]amine Formula: C32H35N5O3S MolecularWeight: 569.717

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC1=CC=CC=C1C2=CC=CS2)C3=NC4=C(N=CN(C4=N3)CC5=CC(=C(C=C5)OC)OC6CCCC6)N

Isomeric SMILES

CC(C)(COC1=CC=CC=C1C2=CC=CS2)C3=NC4=C(N=CN(C4=N3)CC5=CC(=C(C=C5)OC)OC6CCCC6)N

InChI

InChI=1S/C32H35N5O3S/c1-32(2,19-39-24-12-7-6-11-23(24)27-13-8-16-41-27)31-35-28-29(33)34-20-37(30(28)36-31)18-21-14-15-25(38-3)26(17-21)40-22-9-4-5-10-22/h6-8,11-17,20,22H,4-5,9-10,18-19,33H2,1-3H3