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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)C#N)C

InChI

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