1-(4-tert-butyl-2-sulfanyl-phenyl)ethanone

Systemtic Name: 1-(4-tert-butyl-2-sulfanyl-phenyl)ethanone Openeye Name: 1-(4-tert-butyl-2-sulfanyl-phenyl)ethanone CAS Name: 1-(4-tert-butyl-2-mercaptophenyl)ethanone IUPAC Name: 1-(4-tert-butyl-2-sulfanylphenyl)ethanone Traditional Name: 1-(4-tert-butyl-2-mercapto-phenyl)ethanone Formula: C12H16OS MolecularWeight: 208.31984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)C(C)(C)C)S

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)C(C)(C)C)S

InChI

InChI=1S/C12H16OS/c1-8(13)10-6-5-9(7-11(10)14)12(2,3)4/h5-7,14H,1-4H3