(E)-3-(6-ethoxy-2,3-dimethyl-1-benzofuran-5-yl)-N-(3-methylsulfanylphenyl)but-2-enamide

Systemtic Name: (E)-3-(6-ethoxy-2,3-dimethyl-1-benzofuran-5-yl)-N-(3-methylsulfanylphenyl)but-2-enamide Openeye Name: (E)-3-(6-ethoxy-2,3-dimethyl-benzofuran-5-yl)-N-(3-methylsulfanylphenyl)but-2-enamide CAS Name: (E)-3-(6-ethoxy-2,3-dimethyl-5-benzofuranyl)-N-[3-(methylthio)phenyl]-2-butenamide IUPAC Name: (E)-3-(6-ethoxy-2,3-dimethyl-1-benzofuran-5-yl)-N-(3-methylsulfanylphenyl)but-2-enamide Traditional Name: (E)-3-(6-ethoxy-2,3-dimethyl-benzofuran-5-yl)-N-[3-(methylthio)phenyl]but-2-enamide Formula: C23H25NO3S MolecularWeight: 395.5145

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C(OC2=C1)C)C)C(=CC(=O)NC3=CC(=CC=C3)SC)C

Isomeric SMILES

CCOC1=C(C=C2C(=C(OC2=C1)C)C)/C(=C/C(=O)NC3=CC(=CC=C3)SC)/C

InChI

InChI=1S/C23H25NO3S/c1-6-26-21-13-22-20(15(3)16(4)27-22)12-19(21)14(2)10-23(25)24-17-8-7-9-18(11-17)28-5/h7-13H,6H2,1-5H3,(H,24,25)/b14-10+