1-(2,6-dimethylphenyl)-3-(4-methylsulfanylphenyl)propan-1-one

Systemtic Name: 1-(2,6-dimethylphenyl)-3-(4-methylsulfanylphenyl)propan-1-one Openeye Name: 1-(2,6-dimethylphenyl)-3-(4-methylsulfanylphenyl)propan-1-one CAS Name: 1-(2,6-dimethylphenyl)-3-[4-(methylthio)phenyl]-1-propanone IUPAC Name: 1-(2,6-dimethylphenyl)-3-(4-methylsulfanylphenyl)propan-1-one Traditional Name: 1-(2,6-dimethylphenyl)-3-[4-(methylthio)phenyl]propan-1-one Formula: C18H20OS MolecularWeight: 284.4158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(=O)CCC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(=O)CCC2=CC=C(C=C2)SC

InChI

InChI=1S/C18H20OS/c1-13-5-4-6-14(2)18(13)17(19)12-9-15-7-10-16(20-3)11-8-15/h4-8,10-11H,9,12H2,1-3H3