S-(4-methylphenyl) 2-(5-ethyl-1-benzofuran-3-yl)ethanethioate

Systemtic Name: S-(4-methylphenyl) 2-(5-ethyl-1-benzofuran-3-yl)ethanethioate Openeye Name: S-(p-tolyl) 2-(5-ethylbenzofuran-3-yl)ethanethioate CAS Name: 2-(5-ethyl-3-benzofuranyl)ethanethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 2-(5-ethyl-1-benzofuran-3-yl)ethanethioate Traditional Name: 2-(5-ethylbenzofuran-3-yl)ethanethioic acid S-(p-tolyl) ester Formula: C19H18O2S MolecularWeight: 310.41002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC=C2CC(=O)SC3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC2=C(C=C1)OC=C2CC(=O)SC3=CC=C(C=C3)C

InChI

InChI=1S/C19H18O2S/c1-3-14-6-9-18-17(10-14)15(12-21-18)11-19(20)22-16-7-4-13(2)5-8-16/h4-10,12H,3,11H2,1-2H3