3-[[3-[(4-fluorophenyl)sulfonylcarbamoylamino]phenyl]sulfonyl-[(4-nitrophenyl)methyl]amino]-N-oxidanyl-propanamide

Systemtic Name: 3-[[3-[(4-fluorophenyl)sulfonylcarbamoylamino]phenyl]sulfonyl-[(4-nitrophenyl)methyl]amino]-N-oxidanyl-propanamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-3-[3-[[3-(hydroxyamino)-3-oxo-propyl]-[(4-nitrophenyl)methyl]sulfamoyl]phenyl]urea CAS Name: 3-[[3-[[[(4-fluorophenyl)sulfonylamino]-oxomethyl]amino]phenyl]sulfonyl-[(4-nitrophenyl)methyl]amino]-N-hydroxypropanamide IUPAC Name: 3-[[3-[(4-fluorophenyl)sulfonylcarbamoylamino]phenyl]sulfonyl-[(4-nitrophenyl)methyl]amino]-N-hydroxypropanamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-3-[3-[[3-(hydroxyamino)-3-keto-propyl]-(4-nitrobenzyl)sulfamoyl]phenyl]urea Formula: C23H22FN5O9S2 MolecularWeight: 595.577283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N(CCC(=O)NO)CC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N(CCC(=O)NO)CC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H22FN5O9S2/c24-17-6-10-20(11-7-17)39(35,36)27-23(31)25-18-2-1-3-21(14-18)40(37,38)28(13-12-22(30)26-32)15-16-4-8-19(9-5-16)29(33)34/h1-11,14,32H,12-13,15H2,(H,26,30)(H2,25,27,31)