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

Systemtic Name: 3-[[8-ethyl-2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-7H-purin-6-yl]oxy]-4-phenoxy-benzenecarbonitrile Openeye Name: 3-[[8-ethyl-2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-7H-purin-6-yl]oxy]-4-phenoxy-benzonitrile CAS Name: 3-[[8-ethyl-2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-7H-purin-6-yl]oxy]-4-phenoxybenzonitrile IUPAC Name: 3-[[8-ethyl-2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-7H-purin-6-yl]oxy]-4-phenoxybenzonitrile Traditional Name: 3-[[8-ethyl-2-[3-(1-methyl-2-imidazolin-2-yl)phenoxy]-7H-purin-6-yl]oxy]-4-phenoxy-benzonitrile Formula: C30H25N7O3 MolecularWeight: 531.5646

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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)OC6=CC=CC=C6

Isomeric SMILES

CCC1=NC2=C(N1)C(=NC(=N2)OC3=CC=CC(=C3)C4=NCCN4C)OC5=C(C=CC(=C5)C#N)OC6=CC=CC=C6

InChI

InChI=1S/C30H25N7O3/c1-3-25-33-26-27(34-25)35-30(39-22-11-7-8-20(17-22)28-32-14-15-37(28)2)36-29(26)40-24-16-19(18-31)12-13-23(24)38-21-9-5-4-6-10-21/h4-13,16-17H,3,14-15H2,1-2H3,(H,33,34,35,36)