2-(4-chlorophenyl)sulfanyl-1-phenyl-butane-1,3-dione

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-1-phenyl-butane-1,3-dione Openeye Name: 2-(4-chlorophenyl)sulfanyl-1-phenyl-butane-1,3-dione CAS Name: 2-[(4-chlorophenyl)thio]-1-phenylbutane-1,3-dione IUPAC Name: 2-(4-chlorophenyl)sulfanyl-1-phenylbutane-1,3-dione Traditional Name: 2-[(4-chlorophenyl)thio]-1-phenyl-butane-1,3-dione Formula: C16H13ClO2S MolecularWeight: 304.79122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClO2S/c1-11(18)16(15(19)12-5-3-2-4-6-12)20-14-9-7-13(17)8-10-14/h2-10,16H,1H3