(E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(pyridin-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(pyridin-2-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(2-pyridylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(2-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(pyridin-2-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(2-pyridylmethyl)acrylamide Formula: C21H19N5O MolecularWeight: 357.40846

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C=NN2)C=C(C#N)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C=NN2)/C=C(\C#N)/C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C21H19N5O/c1-2-15-6-8-16(9-7-15)20-18(13-25-26-20)11-17(12-22)21(27)24-14-19-5-3-4-10-23-19/h3-11,13H,2,14H2,1H3,(H,24,27)(H,25,26)/b17-11+