N2-(4-azanylcyclohexyl)-N6-[(4-methoxyphenyl)methyl]-9-propan-2-yl-purine-2,6-diamine dihydrochloride

Systemtic Name: N2-(4-azanylcyclohexyl)-N6-[(4-methoxyphenyl)methyl]-9-propan-2-yl-purine-2,6-diamine dihydrochloride Openeye Name: N2-(4-aminocyclohexyl)-9-isopropyl-N6-[(4-methoxyphenyl)methyl]purine-2,6-diamine dihydrochloride CAS Name: N2-(4-aminocyclohexyl)-N6-[(4-methoxyphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine dihydrochloride IUPAC Name: 2-N-(4-aminocyclohexyl)-6-N-[(4-methoxyphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine dihydrochloride Traditional Name: (4-aminocyclohexyl)-[9-isopropyl-6-(p-anisylamino)purin-2-yl]amine dihydrochloride Formula: C22H33Cl2N7O MolecularWeight: 482.44972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)NC4CCC(CC4)N.Cl.Cl

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)NC4CCC(CC4)N.Cl.Cl

InChI

InChI=1S/C22H31N7O.2ClH/c1-14(2)29-13-25-19-20(24-12-15-4-10-18(30-3)11-5-15)27-22(28-21(19)29)26-17-8-6-16(23)7-9-17;;/h4-5,10-11,13-14,16-17H,6-9,12,23H2,1-3H3,(H2,24,26,27,28);2*1H