2-(4-chlorophenyl)-2-[(3-methylsulfonyl-2-oxidanylidene-imidazolidin-1-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-(4-chlorophenyl)-2-[(3-methylsulfonyl-2-oxidanylidene-imidazolidin-1-yl)carbonylamino]ethanoic acid Openeye Name: 2-(4-chlorophenyl)-2-[(3-methylsulfonyl-2-oxo-imidazolidine-1-carbonyl)amino]acetic acid CAS Name: 2-(4-chlorophenyl)-2-[[(3-methylsulfonyl-2-oxo-1-imidazolidinyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-(4-chlorophenyl)-2-[(3-methylsulfonyl-2-oxoimidazolidine-1-carbonyl)amino]acetic acid Traditional Name: 2-(4-chlorophenyl)-2-[(2-keto-3-mesyl-imidazolidine-1-carbonyl)amino]acetic acid Formula: C13H14ClN3O6S MolecularWeight: 375.78476

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(C1=O)C(=O)NC(C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CS(=O)(=O)N1CCN(C1=O)C(=O)NC(C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C13H14ClN3O6S/c1-24(22,23)17-7-6-16(13(17)21)12(20)15-10(11(18)19)8-2-4-9(14)5-3-8/h2-5,10H,6-7H2,1H3,(H,15,20)(H,18,19)