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

Systemtic Name: (E)-3-[3-(3-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-[3-(3-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-[3-(3-chlorophenyl)-1-phenyl-4-pyrazolyl]-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-[3-(3-chlorophenyl)-1-phenylpyrazol-4-yl]-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-[3-(3-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-isopropyl-acrylamide Formula: C22H19ClN4O MolecularWeight: 390.86546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CN(N=C1C2=CC(=CC=C2)Cl)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CN(N=C1C2=CC(=CC=C2)Cl)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C22H19ClN4O/c1-15(2)25-22(28)17(13-24)11-18-14-27(20-9-4-3-5-10-20)26-21(18)16-7-6-8-19(23)12-16/h3-12,14-15H,1-2H3,(H,25,28)/b17-11+