(E)-2-cyano-3-(4-cyanophenyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-cyanophenyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-cyanophenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-cyanophenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-cyanophenyl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-cyanophenyl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acrylamide Formula: C22H17N5O2 MolecularWeight: 383.40268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(=CC3=CC=C(C=C3)C#N)C#N

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)/C(=C/C3=CC=C(C=C3)C#N)/C#N

InChI

InChI=1S/C22H17N5O2/c1-15-20(22(29)27(26(15)2)19-6-4-3-5-7-19)25-21(28)18(14-24)12-16-8-10-17(13-23)11-9-16/h3-12H,1-2H3,(H,25,28)/b18-12+