3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)prop-2-enamide

Systemtic Name: 3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)prop-2-enamide Openeye Name: 3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)prop-2-enamide CAS Name: 3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-2-cyano-N-(4-ethylphenyl)-2-propenamide IUPAC Name: 3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)prop-2-enamide Traditional Name: 3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)acrylamide Formula: C29H22N4O2 MolecularWeight: 458.51058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)C#N

InChI

InChI=1S/C29H22N4O2/c1-2-20-12-14-24(15-13-20)31-29(34)22(18-30)16-23-19-33(25-9-4-3-5-10-25)32-28(23)27-17-21-8-6-7-11-26(21)35-27/h3-17,19H,2H2,1H3,(H,31,34)