(E)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-(2,6-dimethylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-(2,6-dimethylphenyl)prop-2-enamide Openeye Name: (E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-(2,6-dimethylphenyl)prop-2-enamide CAS Name: (E)-3-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-2-cyano-N-(2,6-dimethylphenyl)-2-propenamide IUPAC Name: (E)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-2-cyano-N-(2,6-dimethylphenyl)prop-2-enamide Traditional Name: (E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-(2,6-dimethylphenyl)acrylamide Formula: C22H19ClN4O MolecularWeight: 390.86546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(=CC2=C(N(N=C2C)C3=CC=CC=C3)Cl)C#N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)/C(=C/C2=C(N(N=C2C)C3=CC=CC=C3)Cl)/C#N

InChI

InChI=1S/C22H19ClN4O/c1-14-8-7-9-15(2)20(14)25-22(28)17(13-24)12-19-16(3)26-27(21(19)23)18-10-5-4-6-11-18/h4-12H,1-3H3,(H,25,28)/b17-12+