N6-(3-aminophenyl)-9-[2-(4-aminophenyl)ethyl]-N2-cyclopropyl-purine-2,6-diamine

Systemtic Name: N6-(3-aminophenyl)-9-[2-(4-aminophenyl)ethyl]-N2-cyclopropyl-purine-2,6-diamine Openeye Name: N6-(3-aminophenyl)-9-[2-(4-aminophenyl)ethyl]-N2-cyclopropyl-purine-2,6-diamine CAS Name: N6-(3-aminophenyl)-9-[2-(4-aminophenyl)ethyl]-N2-cyclopropylpurine-2,6-diamine IUPAC Name: 6-N-(3-aminophenyl)-9-[2-(4-aminophenyl)ethyl]-2-N-cyclopropylpurine-2,6-diamine Traditional Name: [6-(3-aminoanilino)-9-[2-(4-aminophenyl)ethyl]purin-2-yl]-cyclopropyl-amine Formula: C22H24N8 MolecularWeight: 400.47956

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC3=C(C(=N2)NC4=CC=CC(=C4)N)N=CN3CCC5=CC=C(C=C5)N

Isomeric SMILES

C1CC1NC2=NC3=C(C(=N2)NC4=CC=CC(=C4)N)N=CN3CCC5=CC=C(C=C5)N

InChI

InChI=1S/C22H24N8/c23-15-6-4-14(5-7-15)10-11-30-13-25-19-20(26-18-3-1-2-16(24)12-18)28-22(29-21(19)30)27-17-8-9-17/h1-7,12-13,17H,8-11,23-24H2,(H2,26,27,28,29)