S-(3-sulfanylpropyl) 2-oxidanylidene-3-phenyl-propanethioate

Systemtic Name: S-(3-sulfanylpropyl) 2-oxidanylidene-3-phenyl-propanethioate Openeye Name: S-(3-sulfanylpropyl) 2-oxo-3-phenyl-propanethioate CAS Name: 2-oxo-3-phenylpropanethioic acid S-(3-mercaptopropyl) ester IUPAC Name: S-(3-sulfanylpropyl) 2-oxo-3-phenylpropanethioate Traditional Name: 2-keto-3-phenyl-propanethioic acid S-(3-mercaptopropyl) ester Formula: C12H14O2S2 MolecularWeight: 254.36836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)C(=O)SCCCS

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)C(=O)SCCCS

InChI

InChI=1S/C12H14O2S2/c13-11(12(14)16-8-4-7-15)9-10-5-2-1-3-6-10/h1-3,5-6,15H,4,7-9H2