4-ethoxy-3-[[8-ethyl-2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-7H-purin-6-yl]oxy]benzenecarbonitrile

Systemtic Name: 4-ethoxy-3-[[8-ethyl-2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-7H-purin-6-yl]oxy]benzenecarbonitrile Openeye Name: 4-ethoxy-3-[[8-ethyl-2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-7H-purin-6-yl]oxy]benzonitrile CAS Name: 4-ethoxy-3-[[8-ethyl-2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-7H-purin-6-yl]oxy]benzonitrile IUPAC Name: 4-ethoxy-3-[[8-ethyl-2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-7H-purin-6-yl]oxy]benzonitrile Traditional Name: 4-ethoxy-3-[[8-ethyl-2-[3-(1-methyl-2-imidazolin-2-yl)phenoxy]-7H-purin-6-yl]oxy]benzonitrile Formula: C26H25N7O3 MolecularWeight: 483.5218

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1)C(=NC(=N2)OC3=CC=CC(=C3)C4=NCCN4C)OC5=C(C=CC(=C5)C#N)OCC

Isomeric SMILES

CCC1=NC2=C(N1)C(=NC(=N2)OC3=CC=CC(=C3)C4=NCCN4C)OC5=C(C=CC(=C5)C#N)OCC

InChI

InChI=1S/C26H25N7O3/c1-4-21-29-22-23(30-21)31-26(35-18-8-6-7-17(14-18)24-28-11-12-33(24)3)32-25(22)36-20-13-16(15-27)9-10-19(20)34-5-2/h6-10,13-14H,4-5,11-12H2,1-3H3,(H,29,30,31,32)