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

Systemtic Name: (E)-2-cyano-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)-N-(2,4,6-trimethylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]-N-(2,4,6-trimethylphenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)-N-(2,4,6-trimethylphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)-N-(2,4,6-trimethylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-mesityl-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]acrylamide Formula: C27H23N5O MolecularWeight: 433.50442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H23N5O/c1-18-13-19(2)25(20(3)14-18)30-27(33)22(16-28)15-23-17-32(24-7-5-4-6-8-24)31-26(23)21-9-11-29-12-10-21/h4-15,17H,1-3H3,(H,30,33)/b22-15+