9-cyclopentyl-N-[(2,6-dimethoxyphenyl)methyl]purin-8-amine dihydrochloride

Systemtic Name: 9-cyclopentyl-N-[(2,6-dimethoxyphenyl)methyl]purin-8-amine dihydrochloride Openeye Name: 9-cyclopentyl-N-[(2,6-dimethoxyphenyl)methyl]purin-8-amine dihydrochloride CAS Name: 9-cyclopentyl-N-[(2,6-dimethoxyphenyl)methyl]-8-purinamine dihydrochloride IUPAC Name: 9-cyclopentyl-N-[(2,6-dimethoxyphenyl)methyl]purin-8-amine dihydrochloride Traditional Name: (9-cyclopentylpurin-8-yl)-(2,6-dimethoxybenzyl)amine dihydrochloride Formula: C19H25Cl2N5O2 MolecularWeight: 426.3401

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)CNC2=NC3=CN=CN=C3N2C4CCCC4.Cl.Cl

Isomeric SMILES

COC1=C(C(=CC=C1)OC)CNC2=NC3=CN=CN=C3N2C4CCCC4.Cl.Cl

InChI

InChI=1S/C19H23N5O2.2ClH/c1-25-16-8-5-9-17(26-2)14(16)10-21-19-23-15-11-20-12-22-18(15)24(19)13-6-3-4-7-13;;/h5,8-9,11-13H,3-4,6-7,10H2,1-2H3,(H,21,23);2*1H