(E)-N-(5-chloranyl-2-methyl-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-(5-chloranyl-2-methyl-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-(5-chloro-2-methyl-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-(5-chloro-2-methylphenyl)-2-cyano-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-(5-chloro-2-methylphenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(5-chloro-2-methyl-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C20H15ClN4O MolecularWeight: 362.8123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C(=CC2=CN(N=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

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

InChI

InChI=1S/C20H15ClN4O/c1-14-7-8-17(21)10-19(14)24-20(26)16(11-22)9-15-12-23-25(13-15)18-5-3-2-4-6-18/h2-10,12-13H,1H3,(H,24,26)/b16-9+