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

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methyl]-8-[1-[(4-fluorophenyl)methoxy]propan-2-yl]purin-6-amine Openeye Name: 3-[(3,4-dimethoxyphenyl)methyl]-8-[2-[(4-fluorophenyl)methoxy]-1-methyl-ethyl]purin-6-amine CAS Name: 3-[(3,4-dimethoxyphenyl)methyl]-8-[1-[(4-fluorophenyl)methoxy]propan-2-yl]-6-purinamine IUPAC Name: 3-[(3,4-dimethoxyphenyl)methyl]-8-[1-[(4-fluorophenyl)methoxy]propan-2-yl]purin-6-amine Traditional Name: [8-[2-(4-fluorobenzyl)oxy-1-methyl-ethyl]-3-veratryl-purin-6-yl]amine Formula: C24H26FN5O3 MolecularWeight: 451.493343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26FN5O3/c1-15(12-33-13-16-4-7-18(25)8-5-16)23-28-21-22(26)27-14-30(24(21)29-23)11-17-6-9-19(31-2)20(10-17)32-3/h4-10,14-15H,11-13,26H2,1-3H3