(E)-2-cyano-N-cyclohexyl-3-[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-cyclohexyl-3-[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-[3-(4-allyloxyphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-cyclohexyl-prop-2-enamide CAS Name: (E)-2-cyano-N-cyclohexyl-3-[1-phenyl-3-(4-prop-2-enoxyphenyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-cyclohexyl-3-[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]prop-2-enamide Traditional Name: (E)-3-[3-(4-allyloxyphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-cyclohexyl-acrylamide Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

C=CCOC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C28H28N4O2/c1-2-17-34-26-15-13-21(14-16-26)27-23(20-32(31-27)25-11-7-4-8-12-25)18-22(19-29)28(33)30-24-9-5-3-6-10-24/h2,4,7-8,11-16,18,20,24H,1,3,5-6,9-10,17H2,(H,30,33)/b22-18+