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

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-[2-methyl-1-(3-thiophen-3-ylphenoxy)propan-2-yl]purin-6-amine Openeye Name: 3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-8-[1,1-dimethyl-2-[3-(3-thienyl)phenoxy]ethyl]purin-6-amine CAS Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-methyl-1-[3-(3-thiophenyl)phenoxy]propan-2-yl]-6-purinamine IUPAC Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-methyl-1-(3-thiophen-3-ylphenoxy)propan-2-yl]purin-6-amine Traditional Name: [3-[3-(cyclopentoxy)-4-methoxy-benzyl]-8-[1,1-dimethyl-2-[3-(3-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(=C1)C2=CSC=C2)C3=NC4=C(N=CN(C4=N3)CC5=CC(=C(C=C5)OC)OC6CCCC6)N

Isomeric SMILES

CC(C)(COC1=CC=CC(=C1)C2=CSC=C2)C3=NC4=C(N=CN(C4=N3)CC5=CC(=C(C=C5)OC)OC6CCCC6)N

InChI

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