S-tert-butyl 4-bromanyl-3-oxidanylidene-pentanethioate

Systemtic Name: S-tert-butyl 4-bromanyl-3-oxidanylidene-pentanethioate Openeye Name: S-tert-butyl 4-bromo-3-oxo-pentanethioate CAS Name: 4-bromo-3-oxopentanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 4-bromo-3-oxopentanethioate Traditional Name: 4-bromo-3-keto-pentanethioic acid S-tert-butyl ester Formula: C9H15BrO2S MolecularWeight: 267.1832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)CC(=O)SC(C)(C)C)Br

Isomeric SMILES

CC(C(=O)CC(=O)SC(C)(C)C)Br

InChI

InChI=1S/C9H15BrO2S/c1-6(10)7(11)5-8(12)13-9(2,3)4/h6H,5H2,1-4H3