1-[(3-tert-butyl-4,5-dimethyl-phenyl)methylsulfanyl]propan-2-one

Systemtic Name: 1-[(3-tert-butyl-4,5-dimethyl-phenyl)methylsulfanyl]propan-2-one Openeye Name: 1-[(3-tert-butyl-4,5-dimethyl-phenyl)methylsulfanyl]propan-2-one CAS Name: 1-[(3-tert-butyl-4,5-dimethylphenyl)methylthio]-2-propanone IUPAC Name: 1-[(3-tert-butyl-4,5-dimethylphenyl)methylsulfanyl]propan-2-one Traditional Name: 1-[(3-tert-butyl-4,5-dimethyl-benzyl)thio]acetone Formula: C16H24OS MolecularWeight: 264.42616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CSCC(=O)C)C(C)(C)C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)CSCC(=O)C)C(C)(C)C)C

InChI

InChI=1S/C16H24OS/c1-11-7-14(10-18-9-12(2)17)8-15(13(11)3)16(4,5)6/h7-8H,9-10H2,1-6H3