ethyl 2-[cyano-(4,6-dimethylpyrimidin-2-yl)amino]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[cyano-(4,6-dimethylpyrimidin-2-yl)amino]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[cyano-(4,6-dimethylpyrimidin-2-yl)amino]-3-oxo-butanoate CAS Name: 2-[cyano-(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[cyano-(4,6-dimethylpyrimidin-2-yl)amino]-3-oxobutanoate Traditional Name: 2-[cyano-(4,6-dimethylpyrimidin-2-yl)amino]-3-keto-butyric acid ethyl ester Formula: C13H16N4O3 MolecularWeight: 276.29114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)N(C#N)C1=NC(=CC(=N1)C)C

Isomeric SMILES

CCOC(=O)C(C(=O)C)N(C#N)C1=NC(=CC(=N1)C)C

InChI

InChI=1S/C13H16N4O3/c1-5-20-12(19)11(10(4)18)17(7-14)13-15-8(2)6-9(3)16-13/h6,11H,5H2,1-4H3