S-(4-tert-butylphenyl) propanethioate

Systemtic Name: S-(4-tert-butylphenyl) propanethioate Openeye Name: S-(4-tert-butylphenyl) propanethioate CAS Name: propanethioic acid S-(4-tert-butylphenyl) ester IUPAC Name: S-(4-tert-butylphenyl) propanethioate Traditional Name: propanethioic acid S-(4-tert-butylphenyl) ester Formula: C13H18OS MolecularWeight: 222.34642

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)SC1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

CCC(=O)SC1=CC=C(C=C1)C(C)(C)C

InChI

InChI=1S/C13H18OS/c1-5-12(14)15-11-8-6-10(7-9-11)13(2,3)4/h6-9H,5H2,1-4H3