methyl 2-[2-(dimethylcarbamoylsulfanyl)-5-(phenylcarbonyl)phenyl]propanoate

Systemtic Name: methyl 2-[2-(dimethylcarbamoylsulfanyl)-5-(phenylcarbonyl)phenyl]propanoate Openeye Name: methyl 2-[5-benzoyl-2-(dimethylcarbamoylsulfanyl)phenyl]propanoate CAS Name: 2-[5-benzoyl-2-[[dimethylamino(oxo)methyl]thio]phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-[5-benzoyl-2-(dimethylcarbamoylsulfanyl)phenyl]propanoate Traditional Name: 2-[5-benzoyl-2-(dimethylcarbamoylthio)phenyl]propionic acid methyl ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)SC(=O)N(C)C)C(=O)OC

Isomeric SMILES

CC(C1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)SC(=O)N(C)C)C(=O)OC

InChI

InChI=1S/C20H21NO4S/c1-13(19(23)25-4)16-12-15(18(22)14-8-6-5-7-9-14)10-11-17(16)26-20(24)21(2)3/h5-13H,1-4H3