2-[2,4-bis(bromanyl)phenyl]-5-methyl-4-(4-methylsulfanylphenyl)cyclohexane-1,3-dione

Systemtic Name: 2-[2,4-bis(bromanyl)phenyl]-5-methyl-4-(4-methylsulfanylphenyl)cyclohexane-1,3-dione Openeye Name: 2-(2,4-dibromophenyl)-5-methyl-4-(4-methylsulfanylphenyl)cyclohexane-1,3-dione CAS Name: 2-(2,4-dibromophenyl)-5-methyl-4-[4-(methylthio)phenyl]cyclohexane-1,3-dione IUPAC Name: 2-(2,4-dibromophenyl)-5-methyl-4-(4-methylsulfanylphenyl)cyclohexane-1,3-dione Traditional Name: 2-(2,4-dibromophenyl)-5-methyl-4-[4-(methylthio)phenyl]cyclohexane-1,3-quinone Formula: C20H18Br2O2S MolecularWeight: 482.22872

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C(=O)C1C2=CC=C(C=C2)SC)C3=C(C=C(C=C3)Br)Br

Isomeric SMILES

CC1CC(=O)C(C(=O)C1C2=CC=C(C=C2)SC)C3=C(C=C(C=C3)Br)Br

InChI

InChI=1S/C20H18Br2O2S/c1-11-9-17(23)19(15-8-5-13(21)10-16(15)22)20(24)18(11)12-3-6-14(25-2)7-4-12/h3-8,10-11,18-19H,9H2,1-2H3