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

Systemtic Name: (E)-2-cyano-3-[3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]-N-prop-2-enyl-prop-2-enamide Openeye Name: (E)-N-allyl-3-[1-benzyl-3-(3-methoxyphenyl)pyrazol-4-yl]-2-cyano-prop-2-enamide CAS Name: (E)-2-cyano-3-[3-(3-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolyl]-N-prop-2-enyl-2-propenamide IUPAC Name: (E)-3-[1-benzyl-3-(3-methoxyphenyl)pyrazol-4-yl]-2-cyano-N-prop-2-enylprop-2-enamide Traditional Name: (E)-N-allyl-3-[1-benzyl-3-(3-methoxyphenyl)pyrazol-4-yl]-2-cyano-acrylamide Formula: C24H22N4O2 MolecularWeight: 398.45708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC=C)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NCC=C)CC3=CC=CC=C3

InChI

InChI=1S/C24H22N4O2/c1-3-12-26-24(29)20(15-25)13-21-17-28(16-18-8-5-4-6-9-18)27-23(21)19-10-7-11-22(14-19)30-2/h3-11,13-14,17H,1,12,16H2,2H3,(H,26,29)/b20-13+