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

Systemtic Name: 2-(4-methylphenyl)-2-[(3-methylsulfonyl-2-oxidanylidene-imidazolidin-1-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(3-methylsulfonyl-2-oxo-imidazolidine-1-carbonyl)amino]-2-(p-tolyl)acetic acid CAS Name: 2-(4-methylphenyl)-2-[[(3-methylsulfonyl-2-oxo-1-imidazolidinyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-(4-methylphenyl)-2-[(3-methylsulfonyl-2-oxoimidazolidine-1-carbonyl)amino]acetic acid Traditional Name: 2-[(2-keto-3-mesyl-imidazolidine-1-carbonyl)amino]-2-(p-tolyl)acetic acid Formula: C14H17N3O6S MolecularWeight: 355.36628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)O)NC(=O)N2CCN(C2=O)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)O)NC(=O)N2CCN(C2=O)S(=O)(=O)C

InChI

InChI=1S/C14H17N3O6S/c1-9-3-5-10(6-4-9)11(12(18)19)15-13(20)16-7-8-17(14(16)21)24(2,22)23/h3-6,11H,7-8H2,1-2H3,(H,15,20)(H,18,19)