S-[2-chloranyl-2-oxidanylidene-1-(phenylcarbonylsulfanyl)ethyl] benzenecarbothioate

Systemtic Name: S-[2-chloranyl-2-oxidanylidene-1-(phenylcarbonylsulfanyl)ethyl] benzenecarbothioate Openeye Name: S-(1-benzoylsulfanyl-2-chloro-2-oxo-ethyl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-[1-(benzoylthio)-2-chloro-2-oxoethyl] ester IUPAC Name: S-(1-benzoylsulfanyl-2-chloro-2-oxoethyl) benzenecarbothioate Traditional Name: thiobenzoic acid S-[1-(benzoylthio)-2-chloro-2-keto-ethyl] ester Formula: C16H11ClO3S2 MolecularWeight: 350.83974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC(C(=O)Cl)SC(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC(C(=O)Cl)SC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H11ClO3S2/c17-13(18)16(21-14(19)11-7-3-1-4-8-11)22-15(20)12-9-5-2-6-10-12/h1-10,16H