(E)-2-cyano-N-(4-ethylphenyl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(4-ethylphenyl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(4-ethylphenyl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-(4-ethylphenyl)-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(4-ethylphenyl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(4-ethylphenyl)-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C21H18N4O MolecularWeight: 342.39382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CN(N=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)/C(=C/C2=CN(N=C2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C21H18N4O/c1-2-16-8-10-19(11-9-16)24-21(26)18(13-22)12-17-14-23-25(15-17)20-6-4-3-5-7-20/h3-12,14-15H,2H2,1H3,(H,24,26)/b18-12+