S-tert-butyl 3-methylbutanethioate

Systemtic Name: S-tert-butyl 3-methylbutanethioate Openeye Name: S-tert-butyl 3-methylbutanethioate CAS Name: 3-methylbutanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 3-methylbutanethioate Traditional Name: 3-methylbutanethioic acid S-tert-butyl ester Formula: C9H18OS MolecularWeight: 174.30362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H18OS/c1-7(2)6-8(10)11-9(3,4)5/h7H,6H2,1-5H3