(E)-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]but-2-enamide

Systemtic Name: (E)-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]but-2-enamide Openeye Name: (E)-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]but-2-enamide CAS Name: (E)-N-[4-cyano-2-(4,6-dimethyl-2-pyrimidinyl)-3-pyrazolyl]-2-butenamide IUPAC Name: (E)-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]but-2-enamide Traditional Name: (E)-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]but-2-enamide Formula: C14H14N6O MolecularWeight: 282.30056

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NC1=C(C=NN1C2=NC(=CC(=N2)C)C)C#N

Isomeric SMILES

C/C=C/C(=O)NC1=C(C=NN1C2=NC(=CC(=N2)C)C)C#N

InChI

InChI=1S/C14H14N6O/c1-4-5-12(21)19-13-11(7-15)8-16-20(13)14-17-9(2)6-10(3)18-14/h4-6,8H,1-3H3,(H,19,21)/b5-4+