N7-(2,2-diphenylethyl)-2-[3-(1H-imidazol-5-yl)propyl]-8,9-dihydropurine-7,8-diamine

Systemtic Name: N7-(2,2-diphenylethyl)-2-[3-(1H-imidazol-5-yl)propyl]-8,9-dihydropurine-7,8-diamine Openeye Name: N7-(2,2-diphenylethyl)-2-[3-(1H-imidazol-5-yl)propyl]-8,9-dihydropurine-7,8-diamine CAS Name: N7-(2,2-diphenylethyl)-2-[3-(1H-imidazol-5-yl)propyl]-8,9-dihydropurine-7,8-diamine IUPAC Name: 7-N-(2,2-diphenylethyl)-2-[3-(1H-imidazol-5-yl)propyl]-8,9-dihydropurine-7,8-diamine Traditional Name: [8-amino-2-[3-(1H-imidazol-5-yl)propyl]-8,9-dihydropurin-7-yl]-(2,2-diphenylethyl)amine Formula: C25H28N8 MolecularWeight: 440.54342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNN2C(NC3=NC(=NC=C32)CCCC4=CN=CN4)N)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(CNN2C(NC3=NC(=NC=C32)CCCC4=CN=CN4)N)C5=CC=CC=C5

InChI

InChI=1S/C25H28N8/c26-25-32-24-22(16-28-23(31-24)13-7-12-20-14-27-17-29-20)33(25)30-15-21(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,14,16-17,21,25,30H,7,12-13,15,26H2,(H,27,29)(H,28,31,32)