methyl (2R)-2-[[5-(dimethylsulfamoyl)-2-fluoranyl-phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[[5-(dimethylsulfamoyl)-2-fluoranyl-phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[5-(dimethylsulfamoyl)-2-fluoro-benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[[5-(dimethylsulfamoyl)-2-fluorophenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[5-(dimethylsulfamoyl)-2-fluorobenzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[5-(dimethylsulfamoyl)-2-fluoro-benzoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C15H21FN2O5S2 MolecularWeight: 392.466043

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C15H21FN2O5S2/c1-18(2)25(21,22)10-5-6-12(16)11(9-10)14(19)17-13(7-8-24-4)15(20)23-3/h5-6,9,13H,7-8H2,1-4H3,(H,17,19)/t13-/m1/s1