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

Systemtic Name: N2-(2-azanylethyl)-N6-[(4-phenylphenyl)methyl]-9-propan-2-yl-purine-2,6-diamine Openeye Name: N2-(2-aminoethyl)-9-isopropyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine CAS Name: N2-(2-aminoethyl)-N6-[(4-phenylphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 2-N-(2-aminoethyl)-6-N-[(4-phenylphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine Traditional Name: 2-aminoethyl-[9-isopropyl-6-[(4-phenylbenzyl)amino]purin-2-yl]amine Formula: C23H27N7 MolecularWeight: 401.50738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NCCN

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NCCN

InChI

InChI=1S/C23H27N7/c1-16(2)30-15-27-20-21(28-23(25-13-12-24)29-22(20)30)26-14-17-8-10-19(11-9-17)18-6-4-3-5-7-18/h3-11,15-16H,12-14,24H2,1-2H3,(H2,25,26,28,29)