4-(4-methylphenyl)sulfanyl-1-phenyl-butan-1-one

Systemtic Name: 4-(4-methylphenyl)sulfanyl-1-phenyl-butan-1-one Openeye Name: 1-phenyl-4-(p-tolylsulfanyl)butan-1-one CAS Name: 4-[(4-methylphenyl)thio]-1-phenyl-1-butanone IUPAC Name: 4-(4-methylphenyl)sulfanyl-1-phenylbutan-1-one Traditional Name: 1-phenyl-4-(p-tolylthio)butan-1-one Formula: C17H18OS MolecularWeight: 270.38922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18OS/c1-14-9-11-16(12-10-14)19-13-5-8-17(18)15-6-3-2-4-7-15/h2-4,6-7,9-12H,5,8,13H2,1H3