3-[(3,4-dimethoxyphenyl)methyl]-8-[2-[(4-methylphenyl)methoxy]propan-2-yl]purin-6-amine

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methyl]-8-[2-[(4-methylphenyl)methoxy]propan-2-yl]purin-6-amine Openeye Name: 3-[(3,4-dimethoxyphenyl)methyl]-8-[1-methyl-1-(p-tolylmethoxy)ethyl]purin-6-amine CAS Name: 3-[(3,4-dimethoxyphenyl)methyl]-8-[2-[(4-methylphenyl)methoxy]propan-2-yl]-6-purinamine IUPAC Name: 3-[(3,4-dimethoxyphenyl)methyl]-8-[2-[(4-methylphenyl)methoxy]propan-2-yl]purin-6-amine Traditional Name: [8-[1-methyl-1-(4-methylbenzyl)oxy-ethyl]-3-veratryl-purin-6-yl]amine Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(C)(C)C2=NC3=C(N=CN(C3=N2)CC4=CC(=C(C=C4)OC)OC)N

Isomeric SMILES

CC1=CC=C(C=C1)COC(C)(C)C2=NC3=C(N=CN(C3=N2)CC4=CC(=C(C=C4)OC)OC)N

InChI

InChI=1S/C25H29N5O3/c1-16-6-8-17(9-7-16)14-33-25(2,3)24-28-21-22(26)27-15-30(23(21)29-24)13-18-10-11-19(31-4)20(12-18)32-5/h6-12,15H,13-14,26H2,1-5H3