N-[[2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl]-2-(3-methoxyphenyl)ethanamide

Systemtic Name: N-[[2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl]-2-(3-methoxyphenyl)ethanamide Openeye Name: N-[[2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl]-2-(3-methoxyphenyl)acetamide CAS Name: N-[[2-cyano-4-(2,2-dimethylpropylamino)-5-pyrimidinyl]methyl]-2-(3-methoxyphenyl)acetamide IUPAC Name: N-[[2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl]-2-(3-methoxyphenyl)acetamide Traditional Name: N-[[2-cyano-4-(neopentylamino)pyrimidin-5-yl]methyl]-2-(3-methoxyphenyl)acetamide Formula: C20H25N5O2 MolecularWeight: 367.4448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC1=NC(=NC=C1CNC(=O)CC2=CC(=CC=C2)OC)C#N

Isomeric SMILES

CC(C)(C)CNC1=NC(=NC=C1CNC(=O)CC2=CC(=CC=C2)OC)C#N

InChI

InChI=1S/C20H25N5O2/c1-20(2,3)13-24-19-15(11-22-17(10-21)25-19)12-23-18(26)9-14-6-5-7-16(8-14)27-4/h5-8,11H,9,12-13H2,1-4H3,(H,23,26)(H,22,24,25)