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

Systemtic Name: (E)-2-cyano-N-(2-methoxyethyl)-3-[3-(2-methyl-4-prop-2-enoxy-phenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-[3-(4-allyloxy-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(2-methoxyethyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(2-methoxyethyl)-3-[3-(2-methyl-4-prop-2-enoxyphenyl)-1-phenyl-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(2-methoxyethyl)-3-[3-(2-methyl-4-prop-2-enoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: (E)-3-[3-(4-allyloxy-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(2-methoxyethyl)acrylamide Formula: C26H26N4O3 MolecularWeight: 442.50964

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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)NCCOC)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C26H26N4O3/c1-4-13-33-23-10-11-24(19(2)15-23)25-21(16-20(17-27)26(31)28-12-14-32-3)18-30(29-25)22-8-6-5-7-9-22/h4-11,15-16,18H,1,12-14H2,2-3H3,(H,28,31)/b20-16+