(E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]acrylamide Formula: C26H19N5O3 MolecularWeight: 449.46076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)C(=CC3=CN(N=C3C4=CC=NC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)/C(=C/C3=CN(N=C3C4=CC=NC=C4)C5=CC=CC=C5)/C#N

InChI

InChI=1S/C26H19N5O3/c27-16-19(26(32)29-21-6-7-23-24(15-21)34-13-12-33-23)14-20-17-31(22-4-2-1-3-5-22)30-25(20)18-8-10-28-11-9-18/h1-11,14-15,17H,12-13H2,(H,29,32)/b19-14+