N8-[2-(1H-indol-3-yl)ethyl]-2-(2-methoxyethoxy)-9-(phenylmethyl)purine-6,8-diamine

Systemtic Name: N8-[2-(1H-indol-3-yl)ethyl]-2-(2-methoxyethoxy)-9-(phenylmethyl)purine-6,8-diamine Openeye Name: 9-benzyl-N8-[2-(1H-indol-3-yl)ethyl]-2-(2-methoxyethoxy)purine-6,8-diamine CAS Name: N8-[2-(1H-indol-3-yl)ethyl]-2-(2-methoxyethoxy)-9-(phenylmethyl)purine-6,8-diamine IUPAC Name: 9-benzyl-8-N-[2-(1H-indol-3-yl)ethyl]-2-(2-methoxyethoxy)purine-6,8-diamine Traditional Name: [6-amino-9-benzyl-2-(2-methoxyethoxy)purin-8-yl]-[2-(1H-indol-3-yl)ethyl]amine Formula: C25H27N7O2 MolecularWeight: 457.52758

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=NC2=C(C(=N1)N)N=C(N2CC3=CC=CC=C3)NCCC4=CNC5=CC=CC=C54

Isomeric SMILES

COCCOC1=NC2=C(C(=N1)N)N=C(N2CC3=CC=CC=C3)NCCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C25H27N7O2/c1-33-13-14-34-25-30-22(26)21-23(31-25)32(16-17-7-3-2-4-8-17)24(29-21)27-12-11-18-15-28-20-10-6-5-9-19(18)20/h2-10,15,28H,11-14,16H2,1H3,(H,27,29)(H2,26,30,31)