2-[2-(3,4-dichlorophenyl)ethyl]-6-oxidanyl-2-phenyl-5-(phenylmethylsulfanyl)-3H-pyran-4-one

Systemtic Name: 2-[2-(3,4-dichlorophenyl)ethyl]-6-oxidanyl-2-phenyl-5-(phenylmethylsulfanyl)-3H-pyran-4-one Openeye Name: 5-benzylsulfanyl-2-[2-(3,4-dichlorophenyl)ethyl]-6-hydroxy-2-phenyl-3H-pyran-4-one CAS Name: 2-[2-(3,4-dichlorophenyl)ethyl]-6-hydroxy-2-phenyl-5-(phenylmethylthio)-3H-pyran-4-one IUPAC Name: 5-benzylsulfanyl-2-[2-(3,4-dichlorophenyl)ethyl]-6-hydroxy-2-phenyl-3H-pyran-4-one Traditional Name: 5-(benzylthio)-2-[2-(3,4-dichlorophenyl)ethyl]-6-hydroxy-2-phenyl-3H-pyran-4-one Formula: C26H22Cl2O3S MolecularWeight: 485.42208

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(OC1(CCC2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3)O)SCC4=CC=CC=C4

Isomeric SMILES

C1C(=O)C(=C(OC1(CCC2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3)O)SCC4=CC=CC=C4

InChI

InChI=1S/C26H22Cl2O3S/c27-21-12-11-18(15-22(21)28)13-14-26(20-9-5-2-6-10-20)16-23(29)24(25(30)31-26)32-17-19-7-3-1-4-8-19/h1-12,15,30H,13-14,16-17H2