S-(2-sulfanylethyl) 4-chloranylbenzenecarbothioate

Systemtic Name: S-(2-sulfanylethyl) 4-chloranylbenzenecarbothioate Openeye Name: S-(2-sulfanylethyl) 4-chlorobenzenecarbothioate CAS Name: 4-chlorobenzenecarbothioic acid S-(2-mercaptoethyl) ester IUPAC Name: S-(2-sulfanylethyl) 4-chlorobenzenecarbothioate Traditional Name: 4-chlorothiobenzoic acid S-(2-mercaptoethyl) ester Formula: C9H9ClOS2 MolecularWeight: 232.75016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)SCCS)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)SCCS)Cl

InChI

InChI=1S/C9H9ClOS2/c10-8-3-1-7(2-4-8)9(11)13-6-5-12/h1-4,12H,5-6H2