(Z)-3-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(furan-2-ylmethyl)prop-2-enamide

Systemtic Name: (Z)-3-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(furan-2-ylmethyl)prop-2-enamide Openeye Name: (Z)-3-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(2-furylmethyl)prop-2-enamide CAS Name: (Z)-3-[3-(1-adamantyl)-1-phenyl-4-pyrazolyl]-2-cyano-N-(2-furanylmethyl)-2-propenamide IUPAC Name: (Z)-3-[3-(1-adamantyl)-1-phenylpyrazol-4-yl]-2-cyano-N-(furan-2-ylmethyl)prop-2-enamide Traditional Name: (Z)-3-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(2-furfuryl)acrylamide Formula: C28H28N4O2 MolecularWeight: 452.54752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4C=C(C#N)C(=O)NCC5=CC=CO5)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4/C=C(/C#N)\C(=O)NCC5=CC=CO5)C6=CC=CC=C6

InChI

InChI=1S/C28H28N4O2/c29-16-22(27(33)30-17-25-7-4-8-34-25)12-23-18-32(24-5-2-1-3-6-24)31-26(23)28-13-19-9-20(14-28)11-21(10-19)15-28/h1-8,12,18-21H,9-11,13-15,17H2,(H,30,33)/b22-12-