4-methyl-4-[(4-methylphenyl)sulfanylmethyl]hept-6-en-2-one

Systemtic Name: 4-methyl-4-[(4-methylphenyl)sulfanylmethyl]hept-6-en-2-one Openeye Name: 4-methyl-4-(p-tolylsulfanylmethyl)hept-6-en-2-one CAS Name: 4-methyl-4-[[(4-methylphenyl)thio]methyl]-6-hepten-2-one IUPAC Name: 4-methyl-4-[(4-methylphenyl)sulfanylmethyl]hept-6-en-2-one Traditional Name: 4-methyl-4-[(p-tolylthio)methyl]hept-6-en-2-one Formula: C16H22OS MolecularWeight: 262.41028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22OS/c1-5-10-16(4,11-14(3)17)12-18-15-8-6-13(2)7-9-15/h5-9H,1,10-12H2,2-4H3