(E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-quinolin-5-yl-prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-quinolin-5-yl-prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(5-quinolyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]-N-(5-quinolinyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]-N-quinolin-5-ylprop-2-enamide Traditional Name: (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(5-quinolyl)acrylamide Formula: C29H21N5O2 MolecularWeight: 471.50934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3=CC=CC4=C3C=CC=N4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC3=CC=CC4=C3C=CC=N4)C5=CC=CC=C5

InChI

InChI=1S/C29H21N5O2/c1-36-24-14-12-20(13-15-24)28-22(19-34(33-28)23-7-3-2-4-8-23)17-21(18-30)29(35)32-27-11-5-10-26-25(27)9-6-16-31-26/h2-17,19H,1H3,(H,32,35)/b21-17+