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

Systemtic Name: (E)-2-cyano-N-cyclohexyl-3-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-cyclohexyl-3-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-cyclohexyl-3-[1-phenyl-3-(4-propoxyphenyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-cyclohexyl-3-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-cyclohexyl-3-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]acrylamide Formula: C28H30N4O2 MolecularWeight: 454.5634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C28H30N4O2/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/h4,7-8,11-16,18,20,24H,2-3,5-6,9-10,17H2,1H3,(H,30,33)/b22-18+