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

Systemtic Name: S-(4-methylphenyl) 2-(5-chloranyl-1-benzofuran-3-yl)ethanethioate Openeye Name: S-(p-tolyl) 2-(5-chlorobenzofuran-3-yl)ethanethioate CAS Name: 2-(5-chloro-3-benzofuranyl)ethanethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 2-(5-chloro-1-benzofuran-3-yl)ethanethioate Traditional Name: 2-(5-chlorobenzofuran-3-yl)ethanethioic acid S-(p-tolyl) ester Formula: C17H13ClO2S MolecularWeight: 316.80192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClO2S/c1-11-2-5-14(6-3-11)21-17(19)8-12-10-20-16-7-4-13(18)9-15(12)16/h2-7,9-10H,8H2,1H3