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

Systemtic Name: N2-(2-methylpropyl)-N6-[(4-phenylphenyl)methyl]-9-propan-2-yl-purine-2,6-diamine Openeye Name: N2-isobutyl-9-isopropyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine CAS Name: N2-(2-methylpropyl)-N6-[(4-phenylphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 2-N-(2-methylpropyl)-6-N-[(4-phenylphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine Traditional Name: isobutyl-[9-isopropyl-6-[(4-phenylbenzyl)amino]purin-2-yl]amine Formula: C25H30N6 MolecularWeight: 414.5459

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC2=C(C(=N1)NCC3=CC=C(C=C3)C4=CC=CC=C4)N=CN2C(C)C

Isomeric SMILES

CC(C)CNC1=NC2=C(C(=N1)NCC3=CC=C(C=C3)C4=CC=CC=C4)N=CN2C(C)C

InChI

InChI=1S/C25H30N6/c1-17(2)14-27-25-29-23(22-24(30-25)31(16-28-22)18(3)4)26-15-19-10-12-21(13-11-19)20-8-6-5-7-9-20/h5-13,16-18H,14-15H2,1-4H3,(H2,26,27,29,30)