[nitro(phenyl)methyl] 3-ethanoylsulfanyl-5-[[3-(methylsulfonylcarbamoyl)phenyl]carbamoyl]pyrrolidine-3-carboxylate

Systemtic Name: [nitro(phenyl)methyl] 3-ethanoylsulfanyl-5-[[3-(methylsulfonylcarbamoyl)phenyl]carbamoyl]pyrrolidine-3-carboxylate Openeye Name: [nitro(phenyl)methyl] 3-acetylsulfanyl-5-[[3-(methylsulfonylcarbamoyl)phenyl]carbamoyl]pyrrolidine-3-carboxylate CAS Name: 3-(acetylthio)-5-[[3-[methanesulfonamido(oxo)methyl]anilino]-oxomethyl]-3-pyrrolidinecarboxylic acid [nitro(phenyl)methyl] ester IUPAC Name: [nitro(phenyl)methyl] 3-acetylsulfanyl-5-[[3-(methylsulfonylcarbamoyl)phenyl]carbamoyl]pyrrolidine-3-carboxylate Traditional Name: 3-(acetylthio)-5-[[3-(mesylcarbamoyl)phenyl]carbamoyl]pyrrolidine-3-carboxylic acid [nitro(phenyl)methyl] ester Formula: C23H24N4O9S2 MolecularWeight: 564.58806

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1(CC(NC1)C(=O)NC2=CC=CC(=C2)C(=O)NS(=O)(=O)C)C(=O)OC(C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)SC1(CC(NC1)C(=O)NC2=CC=CC(=C2)C(=O)NS(=O)(=O)C)C(=O)OC(C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O9S2/c1-14(28)37-23(22(31)36-21(27(32)33)15-7-4-3-5-8-15)12-18(24-13-23)20(30)25-17-10-6-9-16(11-17)19(29)26-38(2,34)35/h3-11,18,21,24H,12-13H2,1-2H3,(H,25,30)(H,26,29)