ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-3-oxidanylidene-1H-pyrazol-5-yl]ethanoate

Systemtic Name: ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-3-oxidanylidene-1H-pyrazol-5-yl]ethanoate Openeye Name: ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-3-oxo-1H-pyrazol-5-yl]acetate CAS Name: 2-[2-(4,6-dimethyl-2-pyrimidinyl)-3-oxo-1H-pyrazol-5-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-3-oxo-1H-pyrazol-5-yl]acetate Traditional Name: 2-[1-(4,6-dimethylpyrimidin-2-yl)-5-keto-3-pyrazolin-3-yl]acetic acid ethyl ester Formula: C13H16N4O3 MolecularWeight: 276.29114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC(=O)N(N1)C2=NC(=CC(=N2)C)C

Isomeric SMILES

CCOC(=O)CC1=CC(=O)N(N1)C2=NC(=CC(=N2)C)C

InChI

InChI=1S/C13H16N4O3/c1-4-20-12(19)7-10-6-11(18)17(16-10)13-14-8(2)5-9(3)15-13/h5-6,16H,4,7H2,1-3H3