2-[7-cyano-1-(2,2-dimethylpropyl)-2-oxidanylidene-4H-pyrimido[4,5-d]pyrimidin-3-yl]ethanamide

Systemtic Name: 2-[7-cyano-1-(2,2-dimethylpropyl)-2-oxidanylidene-4H-pyrimido[4,5-d]pyrimidin-3-yl]ethanamide Openeye Name: 2-[7-cyano-1-(2,2-dimethylpropyl)-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl]acetamide CAS Name: 2-[7-cyano-1-(2,2-dimethylpropyl)-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl]acetamide IUPAC Name: 2-[7-cyano-1-(2,2-dimethylpropyl)-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl]acetamide Traditional Name: 2-(7-cyano-2-keto-1-neopentyl-4H-pyrimido[4,5-d]pyrimidin-3-yl)acetamide Formula: C14H18N6O2 MolecularWeight: 302.33172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C2=NC(=NC=C2CN(C1=O)CC(=O)N)C#N

Isomeric SMILES

CC(C)(C)CN1C2=NC(=NC=C2CN(C1=O)CC(=O)N)C#N

InChI

InChI=1S/C14H18N6O2/c1-14(2,3)8-20-12-9(5-17-11(4-15)18-12)6-19(13(20)22)7-10(16)21/h5H,6-8H2,1-3H3,(H2,16,21)