S-(4-methylphenyl) 5-ethyl-3-methyl-1-benzofuran-2-carbothioate

Systemtic Name: S-(4-methylphenyl) 5-ethyl-3-methyl-1-benzofuran-2-carbothioate Openeye Name: S-(p-tolyl) 5-ethyl-3-methyl-benzofuran-2-carbothioate CAS Name: 5-ethyl-3-methyl-2-benzofurancarbothioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 5-ethyl-3-methyl-1-benzofuran-2-carbothioate Traditional Name: 5-ethyl-3-methyl-benzofuran-2-carbothioic 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(=C2C)C(=O)SC3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=C2C)C(=O)SC3=CC=C(C=C3)C

InChI

InChI=1S/C19H18O2S/c1-4-14-7-10-17-16(11-14)13(3)18(21-17)19(20)22-15-8-5-12(2)6-9-15/h5-11H,4H2,1-3H3