(4-methoxyphenyl) 3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxylate

Systemtic Name: (4-methoxyphenyl) 3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxylate Openeye Name: (4-methoxyphenyl) 3-(benzylsulfanylmethyl)benzofuran-2-carboxylate CAS Name: 3-[(phenylmethylthio)methyl]-2-benzofurancarboxylic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 3-(benzylsulfanylmethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-[(benzylthio)methyl]coumarilic acid (4-methoxyphenyl) ester Formula: C24H20O4S MolecularWeight: 404.4782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20O4S/c1-26-18-11-13-19(14-12-18)27-24(25)23-21(20-9-5-6-10-22(20)28-23)16-29-15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3