(E)-3-[3-(4-chlorophenyl)-6-methoxy-1-benzofuran-5-yl]-N-(3-imidazol-1-ylpropyl)but-2-enamide

Systemtic Name: (E)-3-[3-(4-chlorophenyl)-6-methoxy-1-benzofuran-5-yl]-N-(3-imidazol-1-ylpropyl)but-2-enamide Openeye Name: (E)-3-[3-(4-chlorophenyl)-6-methoxy-benzofuran-5-yl]-N-(3-imidazol-1-ylpropyl)but-2-enamide CAS Name: (E)-3-[3-(4-chlorophenyl)-6-methoxy-5-benzofuranyl]-N-[3-(1-imidazolyl)propyl]-2-butenamide IUPAC Name: (E)-3-[3-(4-chlorophenyl)-6-methoxy-1-benzofuran-5-yl]-N-(3-imidazol-1-ylpropyl)but-2-enamide Traditional Name: (E)-3-[3-(4-chlorophenyl)-6-methoxy-benzofuran-5-yl]-N-(3-imidazol-1-ylpropyl)but-2-enamide Formula: C25H24ClN3O3 MolecularWeight: 449.92936

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NCCCN1C=CN=C1)C2=C(C=C3C(=C2)C(=CO3)C4=CC=C(C=C4)Cl)OC

Isomeric SMILES

C/C(=C\C(=O)NCCCN1C=CN=C1)/C2=C(C=C3C(=C2)C(=CO3)C4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C25H24ClN3O3/c1-17(12-25(30)28-8-3-10-29-11-9-27-16-29)20-13-21-22(18-4-6-19(26)7-5-18)15-32-24(21)14-23(20)31-2/h4-7,9,11-16H,3,8,10H2,1-2H3,(H,28,30)/b17-12+