2-[[(4-chlorophenyl)amino]-sulfanyl-methylidene]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[[(4-chlorophenyl)amino]-sulfanyl-methylidene]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[(4-chloroanilino)-sulfanyl-methylene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[(4-chloroanilino)-mercaptomethylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[(4-chloroanilino)-sulfanylmethylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[(4-chloroanilino)-mercapto-methylene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C15H16ClNO2S MolecularWeight: 309.81104

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=C(NC2=CC=C(C=C2)Cl)S)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=C(NC2=CC=C(C=C2)Cl)S)C(=O)C1)C

InChI

InChI=1S/C15H16ClNO2S/c1-15(2)7-11(18)13(12(19)8-15)14(20)17-10-5-3-9(16)4-6-10/h3-6,17,20H,7-8H2,1-2H3