2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(4-ethylphenyl)prop-2-enamide

Systemtic Name: 2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(4-ethylphenyl)prop-2-enamide Openeye Name: 2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(4-ethylphenyl)prop-2-enamide CAS Name: 2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-N-(4-ethylphenyl)-2-propenamide IUPAC Name: 2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]-N-(4-ethylphenyl)prop-2-enamide Traditional Name: 2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(4-ethylphenyl)acrylamide Formula: C29H26N4O3 MolecularWeight: 478.54174

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4)C#N

InChI

InChI=1S/C29H26N4O3/c1-4-20-10-13-24(14-11-20)31-29(34)22(18-30)16-23-19-33(25-8-6-5-7-9-25)32-28(23)21-12-15-26(35-2)27(17-21)36-3/h5-17,19H,4H2,1-3H3,(H,31,34)