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

Systemtic Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]-N-(3-methylsulfanylphenyl)but-2-enamide Openeye Name: (E)-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]-N-(3-methylsulfanylphenyl)but-2-enamide CAS Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-5-benzofuranyl]-N-[3-(methylthio)phenyl]-2-butenamide IUPAC Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]-N-(3-methylsulfanylphenyl)but-2-enamide Traditional Name: (E)-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]-N-[3-(methylthio)phenyl]but-2-enamide Formula: C27H25NO3S MolecularWeight: 443.5573

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=COC3=CC(=C(C=C32)C(=CC(=O)NC4=CC(=CC=C4)SC)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=COC3=CC(=C(C=C32)/C(=C/C(=O)NC4=CC(=CC=C4)SC)/C)OC

InChI

InChI=1S/C27H25NO3S/c1-17-8-10-19(11-9-17)24-16-31-26-15-25(30-3)22(14-23(24)26)18(2)12-27(29)28-20-6-5-7-21(13-20)32-4/h5-16H,1-4H3,(H,28,29)/b18-12+