S-tert-butyl 2-[3-oxidanylidene-2-(phenylmethyl)cyclopentyl]ethanethioate

Systemtic Name: S-tert-butyl 2-[3-oxidanylidene-2-(phenylmethyl)cyclopentyl]ethanethioate Openeye Name: S-tert-butyl 2-(2-benzyl-3-oxo-cyclopentyl)ethanethioate CAS Name: 2-[3-oxo-2-(phenylmethyl)cyclopentyl]ethanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 2-(2-benzyl-3-oxocyclopentyl)ethanethioate Traditional Name: 2-(2-benzyl-3-keto-cyclopentyl)ethanethioic acid S-tert-butyl ester Formula: C18H24O2S MolecularWeight: 304.44696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC(=O)CC1CCC(=O)C1CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)SC(=O)CC1CCC(=O)C1CC2=CC=CC=C2

InChI

InChI=1S/C18H24O2S/c1-18(2,3)21-17(20)12-14-9-10-16(19)15(14)11-13-7-5-4-6-8-13/h4-8,14-15H,9-12H2,1-3H3