2-(3-chloranyl-4-cyclohexyl-phenyl)-2-(dimethylcarbamoylsulfanyl)ethanoic acid

Systemtic Name: 2-(3-chloranyl-4-cyclohexyl-phenyl)-2-(dimethylcarbamoylsulfanyl)ethanoic acid Openeye Name: 2-(3-chloro-4-cyclohexyl-phenyl)-2-(dimethylcarbamoylsulfanyl)acetic acid CAS Name: 2-(3-chloro-4-cyclohexylphenyl)-2-[[dimethylamino(oxo)methyl]thio]acetic acid IUPAC Name: 2-(3-chloro-4-cyclohexylphenyl)-2-(dimethylcarbamoylsulfanyl)acetic acid Traditional Name: 2-(3-chloro-4-cyclohexyl-phenyl)-2-(dimethylcarbamoylthio)acetic acid Formula: C17H22ClNO3S MolecularWeight: 355.87948

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)SC(C1=CC(=C(C=C1)C2CCCCC2)Cl)C(=O)O

Isomeric SMILES

CN(C)C(=O)SC(C1=CC(=C(C=C1)C2CCCCC2)Cl)C(=O)O

InChI

InChI=1S/C17H22ClNO3S/c1-19(2)17(22)23-15(16(20)21)12-8-9-13(14(18)10-12)11-6-4-3-5-7-11/h8-11,15H,3-7H2,1-2H3,(H,20,21)