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

Systemtic Name: S-(4-methylphenyl) 2-(5-tert-butyl-1-benzofuran-3-yl)ethanethioate Openeye Name: S-(p-tolyl) 2-(5-tert-butylbenzofuran-3-yl)ethanethioate CAS Name: 2-(5-tert-butyl-3-benzofuranyl)ethanethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 2-(5-tert-butyl-1-benzofuran-3-yl)ethanethioate Traditional Name: 2-(5-tert-butylbenzofuran-3-yl)ethanethioic acid S-(p-tolyl) ester Formula: C21H22O2S MolecularWeight: 338.46318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)CC2=COC3=C2C=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)CC2=COC3=C2C=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H22O2S/c1-14-5-8-17(9-6-14)24-20(22)11-15-13-23-19-10-7-16(12-18(15)19)21(2,3)4/h5-10,12-13H,11H2,1-4H3