N2-(2-azanylpropyl)-N6-[(4-chlorophenyl)methyl]-9-propan-2-yl-purine-2,6-diamine

Systemtic Name: N2-(2-azanylpropyl)-N6-[(4-chlorophenyl)methyl]-9-propan-2-yl-purine-2,6-diamine Openeye Name: N2-(2-aminopropyl)-N6-[(4-chlorophenyl)methyl]-9-isopropyl-purine-2,6-diamine CAS Name: N2-(2-aminopropyl)-N6-[(4-chlorophenyl)methyl]-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 2-N-(2-aminopropyl)-6-N-[(4-chlorophenyl)methyl]-9-propan-2-ylpurine-2,6-diamine Traditional Name: 2-aminopropyl-[6-[(4-chlorobenzyl)amino]-9-isopropyl-purin-2-yl]amine Formula: C18H24ClN7 MolecularWeight: 373.88306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)Cl)NCC(C)N

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)Cl)NCC(C)N

InChI

InChI=1S/C18H24ClN7/c1-11(2)26-10-23-15-16(21-9-13-4-6-14(19)7-5-13)24-18(25-17(15)26)22-8-12(3)20/h4-7,10-12H,8-9,20H2,1-3H3,(H2,21,22,24,25)