(E)-3-[3-(1-benzofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]-2-cyano-N-prop-2-enyl-prop-2-enamide

Systemtic Name: (E)-3-[3-(1-benzofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]-2-cyano-N-prop-2-enyl-prop-2-enamide Openeye Name: (E)-N-allyl-3-[3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]-2-cyano-prop-2-enamide CAS Name: (E)-3-[3-(2-benzofuranyl)-1-(phenylmethyl)-4-pyrazolyl]-2-cyano-N-prop-2-enyl-2-propenamide IUPAC Name: (E)-3-[3-(1-benzofuran-2-yl)-1-benzylpyrazol-4-yl]-2-cyano-N-prop-2-enylprop-2-enamide Traditional Name: (E)-N-allyl-3-[3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]-2-cyano-acrylamide Formula: C25H20N4O2 MolecularWeight: 408.4519

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C(=CC1=CN(N=C1C2=CC3=CC=CC=C3O2)CC4=CC=CC=C4)C#N

Isomeric SMILES

C=CCNC(=O)/C(=C/C1=CN(N=C1C2=CC3=CC=CC=C3O2)CC4=CC=CC=C4)/C#N

InChI

InChI=1S/C25H20N4O2/c1-2-12-27-25(30)20(15-26)13-21-17-29(16-18-8-4-3-5-9-18)28-24(21)23-14-19-10-6-7-11-22(19)31-23/h2-11,13-14,17H,1,12,16H2,(H,27,30)/b20-13+