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

Systemtic Name: (E)-2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-methyl-prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-methyl-prop-2-enamide CAS Name: (E)-2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-N-methyl-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]-N-methylprop-2-enamide Traditional Name: (E)-2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-methyl-acrylamide Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(=CC1=CN(N=C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3)C#N

Isomeric SMILES

CNC(=O)/C(=C/C1=CN(N=C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C22H20N4O3/c1-24-22(27)16(13-23)11-17-14-26(18-7-5-4-6-8-18)25-21(17)15-9-10-19(28-2)20(12-15)29-3/h4-12,14H,1-3H3,(H,24,27)/b16-11+