2-(2,6-dimethylphenyl)-4,5-dimethyl-6-(4-methylsulfanylphenyl)cyclohexane-1,3-dione

Systemtic Name: 2-(2,6-dimethylphenyl)-4,5-dimethyl-6-(4-methylsulfanylphenyl)cyclohexane-1,3-dione Openeye Name: 2-(2,6-dimethylphenyl)-4,5-dimethyl-6-(4-methylsulfanylphenyl)cyclohexane-1,3-dione CAS Name: 2-(2,6-dimethylphenyl)-4,5-dimethyl-6-[4-(methylthio)phenyl]cyclohexane-1,3-dione IUPAC Name: 2-(2,6-dimethylphenyl)-4,5-dimethyl-6-(4-methylsulfanylphenyl)cyclohexane-1,3-dione Traditional Name: 2-(2,6-dimethylphenyl)-4,5-dimethyl-6-[4-(methylthio)phenyl]cyclohexane-1,3-quinone Formula: C23H26O2S MolecularWeight: 366.51634

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)C(C(=O)C1C2=CC=C(C=C2)SC)C3=C(C=CC=C3C)C)C

Isomeric SMILES

CC1C(C(=O)C(C(=O)C1C2=CC=C(C=C2)SC)C3=C(C=CC=C3C)C)C

InChI

InChI=1S/C23H26O2S/c1-13-7-6-8-14(2)19(13)21-22(24)16(4)15(3)20(23(21)25)17-9-11-18(26-5)12-10-17/h6-12,15-16,20-21H,1-5H3