1-ethyl-3-[2-methyl-3-(phenylcarbonylsulfanyl)propanoyl]-2-oxidanylidene-imidazolidine-4-carboxylate

Systemtic Name: 1-ethyl-3-[2-methyl-3-(phenylcarbonylsulfanyl)propanoyl]-2-oxidanylidene-imidazolidine-4-carboxylate Openeye Name: 3-(3-benzoylsulfanyl-2-methyl-propanoyl)-1-ethyl-2-oxo-imidazolidine-4-carboxylate CAS Name: 3-[3-(benzoylthio)-2-methyl-1-oxopropyl]-1-ethyl-2-oxo-4-imidazolidinecarboxylate IUPAC Name: 3-(3-benzoylsulfanyl-2-methylpropanoyl)-1-ethyl-2-oxoimidazolidine-4-carboxylate Traditional Name: 3-[3-(benzoylthio)-2-methyl-propanoyl]-1-ethyl-2-keto-imidazolidine-4-carboxylate Formula: C17H19N2O5S- MolecularWeight: 363.40816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(N(C1=O)C(=O)C(C)CSC(=O)C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CCN1CC(N(C1=O)C(=O)C(C)CSC(=O)C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C17H20N2O5S/c1-3-18-9-13(15(21)22)19(17(18)24)14(20)11(2)10-25-16(23)12-7-5-4-6-8-12/h4-8,11,13H,3,9-10H2,1-2H3,(H,21,22)/p-1