1-(4-tert-butylphenyl)sulfanylpropan-2-one

Systemtic Name: 1-(4-tert-butylphenyl)sulfanylpropan-2-one Openeye Name: 1-(4-tert-butylphenyl)sulfanylpropan-2-one CAS Name: 1-[(4-tert-butylphenyl)thio]-2-propanone IUPAC Name: 1-(4-tert-butylphenyl)sulfanylpropan-2-one Traditional Name: 1-[(4-tert-butylphenyl)thio]acetone Formula: C13H18OS MolecularWeight: 222.34642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18OS/c1-10(14)9-15-12-7-5-11(6-8-12)13(2,3)4/h5-8H,9H2,1-4H3