methyl (2R)-2-[[4-chloranyl-3-(methylsulfamoyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[[4-chloranyl-3-(methylsulfamoyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[4-chloro-3-(methylsulfamoyl)benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[[4-chloro-3-(methylsulfamoyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[4-chloro-3-(methylsulfamoyl)benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[4-chloro-3-(methylsulfamoyl)benzoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C14H19ClN2O5S2 MolecularWeight: 394.89406

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C(C=CC(=C1)C(=O)NC(CCSC)C(=O)OC)Cl

Isomeric SMILES

CNS(=O)(=O)C1=C(C=CC(=C1)C(=O)N[C@H](CCSC)C(=O)OC)Cl

InChI

InChI=1S/C14H19ClN2O5S2/c1-16-24(20,21)12-8-9(4-5-10(12)15)13(18)17-11(6-7-23-3)14(19)22-2/h4-5,8,11,16H,6-7H2,1-3H3,(H,17,18)/t11-/m1/s1