N-(2,5-dimethoxyphenyl)-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(benzylsulfanylmethyl)-N-(2,5-dimethoxyphenyl)benzofuran-2-carboxamide CAS Name: N-(2,5-dimethoxyphenyl)-3-[(phenylmethylthio)methyl]-2-benzofurancarboxamide IUPAC Name: 3-(benzylsulfanylmethyl)-N-(2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide Traditional Name: 3-[(benzylthio)methyl]-N-(2,5-dimethoxyphenyl)coumarilamide Formula: C25H23NO4S MolecularWeight: 433.51942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C2=C(C3=CC=CC=C3O2)CSCC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C2=C(C3=CC=CC=C3O2)CSCC4=CC=CC=C4

InChI

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