S-tert-butyl 2-(3-oxidanylidene-2-pentyl-cyclopentyl)ethanethioate

Systemtic Name: S-tert-butyl 2-(3-oxidanylidene-2-pentyl-cyclopentyl)ethanethioate Openeye Name: S-tert-butyl 2-(3-oxo-2-pentyl-cyclopentyl)ethanethioate CAS Name: 2-(3-oxo-2-pentylcyclopentyl)ethanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 2-(3-oxo-2-pentylcyclopentyl)ethanethioate Traditional Name: 2-(2-amyl-3-keto-cyclopentyl)ethanethioic acid S-tert-butyl ester Formula: C16H28O2S MolecularWeight: 284.45732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(CCC1=O)CC(=O)SC(C)(C)C

Isomeric SMILES

CCCCCC1C(CCC1=O)CC(=O)SC(C)(C)C

InChI

InChI=1S/C16H28O2S/c1-5-6-7-8-13-12(9-10-14(13)17)11-15(18)19-16(2,3)4/h12-13H,5-11H2,1-4H3