1-(4-phenylsulfanylphenyl)butane-1,3-dione

Systemtic Name: 1-(4-phenylsulfanylphenyl)butane-1,3-dione Openeye Name: 1-(4-phenylsulfanylphenyl)butane-1,3-dione CAS Name: 1-[4-(phenylthio)phenyl]butane-1,3-dione IUPAC Name: 1-(4-phenylsulfanylphenyl)butane-1,3-dione Traditional Name: 1-[4-(phenylthio)phenyl]butane-1,3-dione Formula: C16H14O2S MolecularWeight: 270.34616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C1=CC=C(C=C1)SC2=CC=CC=C2

Isomeric SMILES

CC(=O)CC(=O)C1=CC=C(C=C1)SC2=CC=CC=C2

InChI

InChI=1S/C16H14O2S/c1-12(17)11-16(18)13-7-9-15(10-8-13)19-14-5-3-2-4-6-14/h2-10H,11H2,1H3