3-[1-[2,6-bis(chloranyl)phenyl]sulfanyl-3-methyl-butyl]-2-oxidanyl-6-phenyl-pyran-4-one

Systemtic Name: 3-[1-[2,6-bis(chloranyl)phenyl]sulfanyl-3-methyl-butyl]-2-oxidanyl-6-phenyl-pyran-4-one Openeye Name: 3-[1-(2,6-dichlorophenyl)sulfanyl-3-methyl-butyl]-2-hydroxy-6-phenyl-pyran-4-one CAS Name: 3-[1-[(2,6-dichlorophenyl)thio]-3-methylbutyl]-2-hydroxy-6-phenyl-4-pyranone IUPAC Name: 3-[1-(2,6-dichlorophenyl)sulfanyl-3-methylbutyl]-2-hydroxy-6-phenylpyran-4-one Traditional Name: 3-[1-[(2,6-dichlorophenyl)thio]-3-methyl-butyl]-2-hydroxy-6-phenyl-pyran-4-one Formula: C22H20Cl2O3S MolecularWeight: 435.3634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=C(OC(=CC1=O)C2=CC=CC=C2)O)SC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CC(C)CC(C1=C(OC(=CC1=O)C2=CC=CC=C2)O)SC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C22H20Cl2O3S/c1-13(2)11-19(28-21-15(23)9-6-10-16(21)24)20-17(25)12-18(27-22(20)26)14-7-4-3-5-8-14/h3-10,12-13,19,26H,11H2,1-2H3