1,4-dimethyl-2,6-bis(oxidanylidene)-3-pentan-2-yl-pyrimidine-5-carbonitrile

Systemtic Name: 1,4-dimethyl-2,6-bis(oxidanylidene)-3-pentan-2-yl-pyrimidine-5-carbonitrile Openeye Name: 1,4-dimethyl-3-(1-methylbutyl)-2,6-dioxo-pyrimidine-5-carbonitrile CAS Name: 1,4-dimethyl-2,6-dioxo-3-pentan-2-yl-5-pyrimidinecarbonitrile IUPAC Name: 1,4-dimethyl-2,6-dioxo-3-pentan-2-ylpyrimidine-5-carbonitrile Traditional Name: 2,6-diketo-1,4-dimethyl-3-(1-methylbutyl)pyrimidine-5-carbonitrile Formula: C12H17N3O2 MolecularWeight: 235.28228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N1C(=C(C(=O)N(C1=O)C)C#N)C

Isomeric SMILES

CCCC(C)N1C(=C(C(=O)N(C1=O)C)C#N)C

InChI

InChI=1S/C12H17N3O2/c1-5-6-8(2)15-9(3)10(7-13)11(16)14(4)12(15)17/h8H,5-6H2,1-4H3