(E)-3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-2-[oxo(1-pyrrolidinyl)methyl]-2-propenenitrile IUPAC Name: (E)-3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-2-(pyrrolidine-1-carbonyl)acrylonitrile Formula: C25H20N4O2 MolecularWeight: 408.4519

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)C#N

Isomeric SMILES

C1CCN(C1)C(=O)/C(=C/C2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)/C#N

InChI

InChI=1S/C25H20N4O2/c26-16-19(25(30)28-12-6-7-13-28)14-20-17-29(21-9-2-1-3-10-21)27-24(20)23-15-18-8-4-5-11-22(18)31-23/h1-5,8-11,14-15,17H,6-7,12-13H2/b19-14+