S-tert-butyl 2-phenylsulfanylethanethioate

Systemtic Name: S-tert-butyl 2-phenylsulfanylethanethioate Openeye Name: S-tert-butyl 2-phenylsulfanylethanethioate CAS Name: 2-(phenylthio)ethanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 2-phenylsulfanylethanethioate Traditional Name: 2-(phenylthio)ethanethioic acid S-tert-butyl ester Formula: C12H16OS2 MolecularWeight: 240.38484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC(=O)CSC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)SC(=O)CSC1=CC=CC=C1

InChI

InChI=1S/C12H16OS2/c1-12(2,3)15-11(13)9-14-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3