methyl 2-[[2-(bromomethyl)-1-(4-methylphenyl)sulfonyl-4-oxidanylidene-imidazolidin-2-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[2-(bromomethyl)-1-(4-methylphenyl)sulfonyl-4-oxidanylidene-imidazolidin-2-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[2-(bromomethyl)-4-oxo-1-(p-tolylsulfonyl)imidazolidine-2-carbonyl]amino]acetate CAS Name: 2-[[[2-(bromomethyl)-1-(4-methylphenyl)sulfonyl-4-oxo-2-imidazolidinyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(bromomethyl)-1-(4-methylphenyl)sulfonyl-4-oxoimidazolidine-2-carbonyl]amino]acetate Traditional Name: 2-[[2-(bromomethyl)-4-keto-1-tosyl-imidazolidine-2-carbonyl]amino]acetic acid methyl ester Formula: C15H18BrN3O6S MolecularWeight: 448.28892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)NC2(CBr)C(=O)NCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)NC2(CBr)C(=O)NCC(=O)OC

InChI

InChI=1S/C15H18BrN3O6S/c1-10-3-5-11(6-4-10)26(23,24)19-8-12(20)18-15(19,9-16)14(22)17-7-13(21)25-2/h3-6H,7-9H2,1-2H3,(H,17,22)(H,18,20)