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

Systemtic Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(pyridin-2-ylmethyl)prop-2-enamide Openeye Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(2-pyridylmethyl)prop-2-enamide CAS Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-N-(2-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]-N-(pyridin-2-ylmethyl)prop-2-enamide Traditional Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(2-pyridylmethyl)acrylamide Formula: C26H24N4O3 MolecularWeight: 440.49376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=CC(=O)NCC3=CC=CC=N3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2/C=C/C(=O)NCC3=CC=CC=N3)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H24N4O3/c1-32-23-13-11-19(16-24(23)33-2)26-20(18-30(29-26)22-9-4-3-5-10-22)12-14-25(31)28-17-21-8-6-7-15-27-21/h3-16,18H,17H2,1-2H3,(H,28,31)/b14-12+