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

Systemtic Name: (E)-3-[3-(4-chlorophenyl)-6-methoxy-1-benzofuran-5-yl]-N-(3-methylsulfanylphenyl)but-2-enamide Openeye Name: (E)-3-[3-(4-chlorophenyl)-6-methoxy-benzofuran-5-yl]-N-(3-methylsulfanylphenyl)but-2-enamide CAS Name: (E)-3-[3-(4-chlorophenyl)-6-methoxy-5-benzofuranyl]-N-[3-(methylthio)phenyl]-2-butenamide IUPAC Name: (E)-3-[3-(4-chlorophenyl)-6-methoxy-1-benzofuran-5-yl]-N-(3-methylsulfanylphenyl)but-2-enamide Traditional Name: (E)-3-[3-(4-chlorophenyl)-6-methoxy-benzofuran-5-yl]-N-[3-(methylthio)phenyl]but-2-enamide Formula: C26H22ClNO3S MolecularWeight: 463.97578

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC(=CC=C1)SC)C2=C(C=C3C(=C2)C(=CO3)C4=CC=C(C=C4)Cl)OC

Isomeric SMILES

C/C(=C\C(=O)NC1=CC(=CC=C1)SC)/C2=C(C=C3C(=C2)C(=CO3)C4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C26H22ClNO3S/c1-16(11-26(29)28-19-5-4-6-20(12-19)32-3)21-13-22-23(17-7-9-18(27)10-8-17)15-31-25(22)14-24(21)30-2/h4-15H,1-3H3,(H,28,29)/b16-11+