3-[[6-(3-cyano-5-phenoxy-phenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide

Systemtic Name: 3-[[6-(3-cyano-5-phenoxy-phenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide Openeye Name: 3-[[6-(3-cyano-5-phenoxy-phenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide CAS Name: 3-[[6-(3-cyano-5-phenoxyphenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[[6-(3-cyano-5-phenoxyphenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethylbenzamide Traditional Name: 3-[[6-(3-cyano-5-phenoxy-phenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide Formula: C29H24N6O4 MolecularWeight: 520.53866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1)C(=NC(=N2)OC3=CC=CC(=C3)C(=O)N(C)C)OC4=CC(=CC(=C4)OC5=CC=CC=C5)C#N

Isomeric SMILES

CCC1=NC2=C(N1)C(=NC(=N2)OC3=CC=CC(=C3)C(=O)N(C)C)OC4=CC(=CC(=C4)OC5=CC=CC=C5)C#N

InChI

InChI=1S/C29H24N6O4/c1-4-24-31-25-26(32-24)33-29(39-21-12-8-9-19(15-21)28(36)35(2)3)34-27(25)38-23-14-18(17-30)13-22(16-23)37-20-10-6-5-7-11-20/h5-16H,4H2,1-3H3,(H,31,32,33,34)