N-[(3-chlorophenyl)methyl]-9-propan-2-yl-purin-8-amine dihydrochloride

Systemtic Name: N-[(3-chlorophenyl)methyl]-9-propan-2-yl-purin-8-amine dihydrochloride Openeye Name: N-[(3-chlorophenyl)methyl]-9-isopropyl-purin-8-amine dihydrochloride CAS Name: N-[(3-chlorophenyl)methyl]-9-propan-2-yl-8-purinamine dihydrochloride IUPAC Name: N-[(3-chlorophenyl)methyl]-9-propan-2-ylpurin-8-amine dihydrochloride Traditional Name: (3-chlorobenzyl)-(9-isopropylpurin-8-yl)amine dihydrochloride Formula: C15H18Cl3N5 MolecularWeight: 374.69592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=NC=C2N=C1NCC3=CC(=CC=C3)Cl.Cl.Cl

Isomeric SMILES

CC(C)N1C2=NC=NC=C2N=C1NCC3=CC(=CC=C3)Cl.Cl.Cl

InChI

InChI=1S/C15H16ClN5.2ClH/c1-10(2)21-14-13(8-17-9-19-14)20-15(21)18-7-11-4-3-5-12(16)6-11;;/h3-6,8-10H,7H2,1-2H3,(H,18,20);2*1H