S-[2-[4-[(2-methylphenyl)methylsulfonylmethyl]phenyl]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[4-[(2-methylphenyl)methylsulfonylmethyl]phenyl]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[4-(o-tolylmethylsulfonylmethyl)phenyl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[4-[(2-methylphenyl)methylsulfonylmethyl]phenyl]-2-oxoethyl] ester IUPAC Name: S-[2-[4-[(2-methylphenyl)methylsulfonylmethyl]phenyl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[4-[(2-methylbenzyl)sulfonylmethyl]phenyl]ethyl] ester Formula: C19H20O4S2 MolecularWeight: 376.4897

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)CC2=CC=C(C=C2)C(=O)CSC(=O)C

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)CC2=CC=C(C=C2)C(=O)CSC(=O)C

InChI

InChI=1S/C19H20O4S2/c1-14-5-3-4-6-18(14)13-25(22,23)12-16-7-9-17(10-8-16)19(21)11-24-15(2)20/h3-10H,11-13H2,1-2H3