3-[[6-(4-cyano-3-methyl-phenoxy)-8-methyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide

Systemtic Name: 3-[[6-(4-cyano-3-methyl-phenoxy)-8-methyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide Openeye Name: 3-[[6-(4-cyano-3-methyl-phenoxy)-8-methyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide CAS Name: 3-[[6-(4-cyano-3-methylphenoxy)-8-methyl-7H-purin-2-yl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[[6-(4-cyano-3-methylphenoxy)-8-methyl-7H-purin-2-yl]oxy]-N,N-dimethylbenzamide Traditional Name: 3-[[6-(4-cyano-3-methyl-phenoxy)-8-methyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide Formula: C23H20N6O3 MolecularWeight: 428.4433

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC(=NC3=C2NC(=N3)C)OC4=CC=CC(=C4)C(=O)N(C)C)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC(=NC3=C2NC(=N3)C)OC4=CC=CC(=C4)C(=O)N(C)C)C#N

InChI

InChI=1S/C23H20N6O3/c1-13-10-18(9-8-16(13)12-24)31-21-19-20(26-14(2)25-19)27-23(28-21)32-17-7-5-6-15(11-17)22(30)29(3)4/h5-11H,1-4H3,(H,25,26,27,28)