3-[2-(3-methoxy-4-oxidanyl-phenyl)-3-methylsulfanyl-1-benzofuran-5-yl]-N-phenyl-propanamide

Systemtic Name: 3-[2-(3-methoxy-4-oxidanyl-phenyl)-3-methylsulfanyl-1-benzofuran-5-yl]-N-phenyl-propanamide Openeye Name: 3-[2-(4-hydroxy-3-methoxy-phenyl)-3-methylsulfanyl-benzofuran-5-yl]-N-phenyl-propanamide CAS Name: 3-[2-(4-hydroxy-3-methoxyphenyl)-3-(methylthio)-5-benzofuranyl]-N-phenylpropanamide IUPAC Name: 3-[2-(4-hydroxy-3-methoxyphenyl)-3-methylsulfanyl-1-benzofuran-5-yl]-N-phenylpropanamide Traditional Name: 3-[2-(4-hydroxy-3-methoxy-phenyl)-3-(methylthio)benzofuran-5-yl]-N-phenyl-propionamide Formula: C25H23NO4S MolecularWeight: 433.51942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=C(C3=C(O2)C=CC(=C3)CCC(=O)NC4=CC=CC=C4)SC)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2=C(C3=C(O2)C=CC(=C3)CCC(=O)NC4=CC=CC=C4)SC)O

InChI

InChI=1S/C25H23NO4S/c1-29-22-15-17(10-11-20(22)27)24-25(31-2)19-14-16(8-12-21(19)30-24)9-13-23(28)26-18-6-4-3-5-7-18/h3-8,10-12,14-15,27H,9,13H2,1-2H3,(H,26,28)