[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 5-(dimethylsulfamoyl)-2-fluoranyl-benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 5-(dimethylsulfamoyl)-2-fluoranyl-benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 5-(dimethylsulfamoyl)-2-fluoro-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-fluorobenzoic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 5-(dimethylsulfamoyl)-2-fluorobenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-fluoro-benzoic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C15H21FN2O5S MolecularWeight: 360.401043

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C)F

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C)F

InChI

InChI=1S/C15H21FN2O5S/c1-5-8-17-14(19)10(2)23-15(20)12-9-11(6-7-13(12)16)24(21,22)18(3)4/h6-7,9-10H,5,8H2,1-4H3,(H,17,19)/t10-/m0/s1