3-methyl-3-[(4-methylphenyl)sulfanylmethyl]-1-phenyl-hex-5-en-1-one

Systemtic Name: 3-methyl-3-[(4-methylphenyl)sulfanylmethyl]-1-phenyl-hex-5-en-1-one Openeye Name: 3-methyl-1-phenyl-3-(p-tolylsulfanylmethyl)hex-5-en-1-one CAS Name: 3-methyl-3-[[(4-methylphenyl)thio]methyl]-1-phenyl-5-hexen-1-one IUPAC Name: 3-methyl-3-[(4-methylphenyl)sulfanylmethyl]-1-phenylhex-5-en-1-one Traditional Name: 3-methyl-1-phenyl-3-[(p-tolylthio)methyl]hex-5-en-1-one Formula: C21H24OS MolecularWeight: 324.47966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(C)(CC=C)CC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)SCC(C)(CC=C)CC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H24OS/c1-4-14-21(3,15-20(22)18-8-6-5-7-9-18)16-23-19-12-10-17(2)11-13-19/h4-13H,1,14-16H2,2-3H3