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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-1-ethanoyl-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one Openeye Name: 1-acetyl-3-[(4-chlorophenyl)methylsulfanyl]-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one CAS Name: 1-acetyl-3-[(4-chlorophenyl)methylthio]-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one IUPAC Name: 1-acetyl-3-[(4-chlorophenyl)methylsulfanyl]-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one Traditional Name: 1-acetyl-3-[(4-chlorobenzyl)thio]-6,6-dimethyl-5,7-dihydroisobenzothiophen-4-one Formula: C19H19ClO2S2 MolecularWeight: 378.93596

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2CC(CC(=O)C2=C(S1)SCC3=CC=C(C=C3)Cl)(C)C

Isomeric SMILES

CC(=O)C1=C2CC(CC(=O)C2=C(S1)SCC3=CC=C(C=C3)Cl)(C)C

InChI

InChI=1S/C19H19ClO2S2/c1-11(21)17-14-8-19(2,3)9-15(22)16(14)18(24-17)23-10-12-4-6-13(20)7-5-12/h4-7H,8-10H2,1-3H3