(E)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(2-methylphenyl)prop-2-enamide

Systemtic Name: (E)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(2-methylphenyl)prop-2-enamide Openeye Name: (E)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(o-tolyl)prop-2-enamide CAS Name: (E)-3-[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]-2-cyano-N-(2-methylphenyl)-2-propenamide IUPAC Name: (E)-3-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-2-cyano-N-(2-methylphenyl)prop-2-enamide Traditional Name: (E)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(o-tolyl)acrylamide Formula: C26H19ClN4O MolecularWeight: 438.90826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)/C(=C/C2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)/C#N

InChI

InChI=1S/C26H19ClN4O/c1-18-7-5-6-10-24(18)29-26(32)20(16-28)15-21-17-31(23-8-3-2-4-9-23)30-25(21)19-11-13-22(27)14-12-19/h2-15,17H,1H3,(H,29,32)/b20-15+