2-(2-chloranyl-4-phenyl-phenyl)-2-(diethylcarbamoylsulfanyl)propanoic acid

Systemtic Name: 2-(2-chloranyl-4-phenyl-phenyl)-2-(diethylcarbamoylsulfanyl)propanoic acid Openeye Name: 2-(2-chloro-4-phenyl-phenyl)-2-(diethylcarbamoylsulfanyl)propanoic acid CAS Name: 2-(2-chloro-4-phenylphenyl)-2-[[diethylamino(oxo)methyl]thio]propanoic acid IUPAC Name: 2-(2-chloro-4-phenylphenyl)-2-(diethylcarbamoylsulfanyl)propanoic acid Traditional Name: 2-(2-chloro-4-phenyl-phenyl)-2-(diethylcarbamoylthio)propionic acid Formula: C20H22ClNO3S MolecularWeight: 391.91158

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)SC(C)(C1=C(C=C(C=C1)C2=CC=CC=C2)Cl)C(=O)O

Isomeric SMILES

CCN(CC)C(=O)SC(C)(C1=C(C=C(C=C1)C2=CC=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C20H22ClNO3S/c1-4-22(5-2)19(25)26-20(3,18(23)24)16-12-11-15(13-17(16)21)14-9-7-6-8-10-14/h6-13H,4-5H2,1-3H3,(H,23,24)