S-[4,5-bis(chloranyl)-2-(2-cyclohexylpropanoylamino)phenyl] 2,2-dimethylpropanethioate

Systemtic Name: S-[4,5-bis(chloranyl)-2-(2-cyclohexylpropanoylamino)phenyl] 2,2-dimethylpropanethioate Openeye Name: S-[4,5-dichloro-2-(2-cyclohexylpropanoylamino)phenyl] 2,2-dimethylpropanethioate CAS Name: 2,2-dimethylpropanethioic acid S-[4,5-dichloro-2-[(2-cyclohexyl-1-oxopropyl)amino]phenyl] ester IUPAC Name: S-[4,5-dichloro-2-(2-cyclohexylpropanoylamino)phenyl] 2,2-dimethylpropanethioate Traditional Name: 2,2-dimethylpropanethioic acid S-[4,5-dichloro-2-(2-cyclohexylpropanoylamino)phenyl] ester Formula: C20H27Cl2NO2S MolecularWeight: 416.40488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)C(=O)NC2=CC(=C(C=C2SC(=O)C(C)(C)C)Cl)Cl

Isomeric SMILES

CC(C1CCCCC1)C(=O)NC2=CC(=C(C=C2SC(=O)C(C)(C)C)Cl)Cl

InChI

InChI=1S/C20H27Cl2NO2S/c1-12(13-8-6-5-7-9-13)18(24)23-16-10-14(21)15(22)11-17(16)26-19(25)20(2,3)4/h10-13H,5-9H2,1-4H3,(H,23,24)