1-(2,2-dimethylpropyl)-2-oxidanylidene-3,4-dihydropyrimido[4,5-d]pyrimidine-7-carbonitrile

Systemtic Name: 1-(2,2-dimethylpropyl)-2-oxidanylidene-3,4-dihydropyrimido[4,5-d]pyrimidine-7-carbonitrile Openeye Name: 1-(2,2-dimethylpropyl)-2-oxo-3,4-dihydropyrimido[4,5-d]pyrimidine-7-carbonitrile CAS Name: 1-(2,2-dimethylpropyl)-2-oxo-3,4-dihydropyrimido[4,5-d]pyrimidine-7-carbonitrile IUPAC Name: 1-(2,2-dimethylpropyl)-2-oxo-3,4-dihydropyrimido[4,5-d]pyrimidine-7-carbonitrile Traditional Name: 2-keto-1-neopentyl-3,4-dihydropyrimido[4,5-d]pyrimidine-7-carbonitrile Formula: C12H15N5O MolecularWeight: 245.2804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C2=NC(=NC=C2CNC1=O)C#N

Isomeric SMILES

CC(C)(C)CN1C2=NC(=NC=C2CNC1=O)C#N

InChI

InChI=1S/C12H15N5O/c1-12(2,3)7-17-10-8(6-15-11(17)18)5-14-9(4-13)16-10/h5H,6-7H2,1-3H3,(H,15,18)