1-methyl-3-[2-methyl-3-(phenylcarbonylsulfanyl)propanoyl]-2-oxidanylidene-imidazolidine-4-carboxylic acid

Systemtic Name: 1-methyl-3-[2-methyl-3-(phenylcarbonylsulfanyl)propanoyl]-2-oxidanylidene-imidazolidine-4-carboxylic acid Openeye Name: 3-(3-benzoylsulfanyl-2-methyl-propanoyl)-1-methyl-2-oxo-imidazolidine-4-carboxylic acid CAS Name: 3-[3-(benzoylthio)-2-methyl-1-oxopropyl]-1-methyl-2-oxo-4-imidazolidinecarboxylic acid IUPAC Name: 3-(3-benzoylsulfanyl-2-methylpropanoyl)-1-methyl-2-oxoimidazolidine-4-carboxylic acid Traditional Name: 3-[3-(benzoylthio)-2-methyl-propanoyl]-2-keto-1-methyl-imidazolidine-4-carboxylic acid Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C1=CC=CC=C1)C(=O)N2C(CN(C2=O)C)C(=O)O

Isomeric SMILES

CC(CSC(=O)C1=CC=CC=C1)C(=O)N2C(CN(C2=O)C)C(=O)O

InChI

InChI=1S/C16H18N2O5S/c1-10(9-24-15(22)11-6-4-3-5-7-11)13(19)18-12(14(20)21)8-17(2)16(18)23/h3-7,10,12H,8-9H2,1-2H3,(H,20,21)