[2-oxidanylidene-2-(2-oxidanylideneimidazolidin-1-yl)ethyl] 2-[(4-methylsulfanyl-3-nitro-phenyl)sulfonylamino]ethanoate

Systemtic Name: [2-oxidanylidene-2-(2-oxidanylideneimidazolidin-1-yl)ethyl] 2-[(4-methylsulfanyl-3-nitro-phenyl)sulfonylamino]ethanoate Openeye Name: [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-[(4-methylsulfanyl-3-nitro-phenyl)sulfonylamino]acetate CAS Name: 2-[[4-(methylthio)-3-nitrophenyl]sulfonylamino]acetic acid [2-oxo-2-(2-oxo-1-imidazolidinyl)ethyl] ester IUPAC Name: [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-[(4-methylsulfanyl-3-nitrophenyl)sulfonylamino]acetate Traditional Name: 2-[[4-(methylthio)-3-nitro-phenyl]sulfonylamino]acetic acid [2-keto-2-(2-ketoimidazolidin-1-yl)ethyl] ester Formula: C14H16N4O8S2 MolecularWeight: 432.42884

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC(=O)N2CCNC2=O)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC(=O)N2CCNC2=O)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O8S2/c1-27-11-3-2-9(6-10(11)18(22)23)28(24,25)16-7-13(20)26-8-12(19)17-5-4-15-14(17)21/h2-3,6,16H,4-5,7-8H2,1H3,(H,15,21)