9-cyclopentyl-N-[(2,4-dimethoxyphenyl)methyl]purin-2-amine dihydrochloride

Systemtic Name: 9-cyclopentyl-N-[(2,4-dimethoxyphenyl)methyl]purin-2-amine dihydrochloride Openeye Name: 9-cyclopentyl-N-[(2,4-dimethoxyphenyl)methyl]purin-2-amine dihydrochloride CAS Name: 9-cyclopentyl-N-[(2,4-dimethoxyphenyl)methyl]-2-purinamine dihydrochloride IUPAC Name: 9-cyclopentyl-N-[(2,4-dimethoxyphenyl)methyl]purin-2-amine dihydrochloride Traditional Name: (9-cyclopentylpurin-2-yl)-(2,4-dimethoxybenzyl)amine dihydrochloride Formula: C19H25Cl2N5O2 MolecularWeight: 426.3401

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC2=NC=C3C(=N2)N(C=N3)C4CCCC4)OC.Cl.Cl

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=NC=C3C(=N2)N(C=N3)C4CCCC4)OC.Cl.Cl

InChI

InChI=1S/C19H23N5O2.2ClH/c1-25-15-8-7-13(17(9-15)26-2)10-20-19-21-11-16-18(23-19)24(12-22-16)14-5-3-4-6-14;;/h7-9,11-12,14H,3-6,10H2,1-2H3,(H,20,21,23);2*1H