(E)-2-cyano-N-(2,6-dimethylphenyl)-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2,6-dimethylphenyl)-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(2,6-dimethylphenyl)-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-(2,6-dimethylphenyl)-3-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(2,6-dimethylphenyl)-3-(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(2,6-dimethylphenyl)-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]acrylamide Formula: C26H21N5O MolecularWeight: 419.47784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(=CC2=CN(N=C2C3=CC=NC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)/C(=C/C2=CN(N=C2C3=CC=NC=C3)C4=CC=CC=C4)/C#N

InChI

InChI=1S/C26H21N5O/c1-18-7-6-8-19(2)24(18)29-26(32)21(16-27)15-22-17-31(23-9-4-3-5-10-23)30-25(22)20-11-13-28-14-12-20/h3-15,17H,1-2H3,(H,29,32)/b21-15+