S-tert-butyl 2-oxidanylidene-2-phenyl-ethanethioate

Systemtic Name: S-tert-butyl 2-oxidanylidene-2-phenyl-ethanethioate Openeye Name: S-tert-butyl 2-oxo-2-phenyl-ethanethioate CAS Name: 2-oxo-2-phenylethanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 2-oxo-2-phenylethanethioate Traditional Name: 2-keto-2-phenyl-ethanethioic acid S-tert-butyl ester Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O2S/c1-12(2,3)15-11(14)10(13)9-7-5-4-6-8-9/h4-8H,1-3H3