S-tert-butyl (3S)-3-(furan-2-yl)-5-oxidanylidene-hexanethioate

Systemtic Name: S-tert-butyl (3S)-3-(furan-2-yl)-5-oxidanylidene-hexanethioate Openeye Name: S-tert-butyl (3S)-3-(2-furyl)-5-oxo-hexanethioate CAS Name: (3S)-3-(2-furanyl)-5-oxohexanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (3S)-3-(furan-2-yl)-5-oxohexanethioate Traditional Name: (3S)-3-(2-furyl)-5-keto-hexanethioic acid S-tert-butyl ester Formula: C14H20O3S MolecularWeight: 268.3718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(CC(=O)SC(C)(C)C)C1=CC=CO1

Isomeric SMILES

CC(=O)C[C@@H](CC(=O)SC(C)(C)C)C1=CC=CO1

InChI

InChI=1S/C14H20O3S/c1-10(15)8-11(12-6-5-7-17-12)9-13(16)18-14(2,3)4/h5-7,11H,8-9H2,1-4H3/t11-/m0/s1