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

Systemtic Name: N2-(2-azanyl-2-methyl-propyl)-N6-[(4-chlorophenyl)methyl]-9-propan-2-yl-purine-2,6-diamine Openeye Name: N2-(2-amino-2-methyl-propyl)-N6-[(4-chlorophenyl)methyl]-9-isopropyl-purine-2,6-diamine CAS Name: N2-(2-amino-2-methylpropyl)-N6-[(4-chlorophenyl)methyl]-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 2-N-(2-amino-2-methylpropyl)-6-N-[(4-chlorophenyl)methyl]-9-propan-2-ylpurine-2,6-diamine Traditional Name: (2-amino-2-methyl-propyl)-[6-[(4-chlorobenzyl)amino]-9-isopropyl-purin-2-yl]amine Formula: C19H26ClN7 MolecularWeight: 387.90964

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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)(C)N

Isomeric SMILES

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

InChI

InChI=1S/C19H26ClN7/c1-12(2)27-11-24-15-16(22-9-13-5-7-14(20)8-6-13)25-18(26-17(15)27)23-10-19(3,4)21/h5-8,11-12H,9-10,21H2,1-4H3,(H2,22,23,25,26)