(E)-2-cyano-3-[3-(2-methyl-4-prop-2-enoxy-phenyl)-1-phenyl-pyrazol-4-yl]-N-(pyridin-3-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-(2-methyl-4-prop-2-enoxy-phenyl)-1-phenyl-pyrazol-4-yl]-N-(pyridin-3-ylmethyl)prop-2-enamide Openeye Name: (E)-3-[3-(4-allyloxy-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(3-pyridylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-(2-methyl-4-prop-2-enoxyphenyl)-1-phenyl-4-pyrazolyl]-N-(3-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-(2-methyl-4-prop-2-enoxyphenyl)-1-phenylpyrazol-4-yl]-N-(pyridin-3-ylmethyl)prop-2-enamide Traditional Name: (E)-3-[3-(4-allyloxy-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(3-pyridylmethyl)acrylamide Formula: C29H25N5O2 MolecularWeight: 475.5411

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC=C)C2=NN(C=C2C=C(C#N)C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)OCC=C)C2=NN(C=C2/C=C(\C#N)/C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H25N5O2/c1-3-14-36-26-11-12-27(21(2)15-26)28-24(20-34(33-28)25-9-5-4-6-10-25)16-23(17-30)29(35)32-19-22-8-7-13-31-18-22/h3-13,15-16,18,20H,1,14,19H2,2H3,(H,32,35)/b23-16+