2-[3,5-bis(chloranyl)phenyl]-6-oxidanyl-5-(phenylmethylsulfanyl)-2,3-dihydropyran-4-one

Systemtic Name: 2-[3,5-bis(chloranyl)phenyl]-6-oxidanyl-5-(phenylmethylsulfanyl)-2,3-dihydropyran-4-one Openeye Name: 5-benzylsulfanyl-2-(3,5-dichlorophenyl)-6-hydroxy-2,3-dihydropyran-4-one CAS Name: 2-(3,5-dichlorophenyl)-6-hydroxy-5-(phenylmethylthio)-2,3-dihydropyran-4-one IUPAC Name: 5-benzylsulfanyl-2-(3,5-dichlorophenyl)-6-hydroxy-2,3-dihydropyran-4-one Traditional Name: 5-(benzylthio)-2-(3,5-dichlorophenyl)-6-hydroxy-2,3-dihydropyran-4-one Formula: C18H14Cl2O3S MolecularWeight: 381.27296

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=C(C1=O)SCC2=CC=CC=C2)O)C3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

C1C(OC(=C(C1=O)SCC2=CC=CC=C2)O)C3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C18H14Cl2O3S/c19-13-6-12(7-14(20)8-13)16-9-15(21)17(18(22)23-16)24-10-11-4-2-1-3-5-11/h1-8,16,22H,9-10H2