3-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-1-ethanoyl-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one

Systemtic Name: 3-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-1-ethanoyl-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one Openeye Name: 1-acetyl-3-[(2,6-dichlorophenyl)methylsulfanyl]-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one CAS Name: 1-acetyl-3-[(2,6-dichlorophenyl)methylthio]-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one IUPAC Name: 1-acetyl-3-[(2,6-dichlorophenyl)methylsulfanyl]-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one Traditional Name: 1-acetyl-3-[(2,6-dichlorobenzyl)thio]-6,6-dimethyl-5,7-dihydroisobenzothiophen-4-one Formula: C19H18Cl2O2S2 MolecularWeight: 413.38102

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2CC(CC(=O)C2=C(S1)SCC3=C(C=CC=C3Cl)Cl)(C)C

Isomeric SMILES

CC(=O)C1=C2CC(CC(=O)C2=C(S1)SCC3=C(C=CC=C3Cl)Cl)(C)C

InChI

InChI=1S/C19H18Cl2O2S2/c1-10(22)17-11-7-19(2,3)8-15(23)16(11)18(25-17)24-9-12-13(20)5-4-6-14(12)21/h4-6H,7-9H2,1-3H3