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

Systemtic Name: 3-[2-methyl-3-(phenylcarbonylsulfanyl)propanoyl]-2-oxidanylidene-1-(phenylmethyl)imidazolidine-4-carboxylic acid Openeye Name: 3-(3-benzoylsulfanyl-2-methyl-propanoyl)-1-benzyl-2-oxo-imidazolidine-4-carboxylic acid CAS Name: 3-[3-(benzoylthio)-2-methyl-1-oxopropyl]-2-oxo-1-(phenylmethyl)-4-imidazolidinecarboxylic acid IUPAC Name: 3-(3-benzoylsulfanyl-2-methylpropanoyl)-1-benzyl-2-oxoimidazolidine-4-carboxylic acid Traditional Name: 3-[3-(benzoylthio)-2-methyl-propanoyl]-1-benzyl-2-keto-imidazolidine-4-carboxylic acid Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C1=CC=CC=C1)C(=O)N2C(CN(C2=O)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(CSC(=O)C1=CC=CC=C1)C(=O)N2C(CN(C2=O)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H22N2O5S/c1-15(14-30-21(28)17-10-6-3-7-11-17)19(25)24-18(20(26)27)13-23(22(24)29)12-16-8-4-2-5-9-16/h2-11,15,18H,12-14H2,1H3,(H,26,27)