[(2S)-1-oxidanylidene-1-[[4-(propan-2-ylsulfamoyl)phenyl]amino]propan-2-yl] 3-methylsulfanylpropanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[[4-(propan-2-ylsulfamoyl)phenyl]amino]propan-2-yl] 3-methylsulfanylpropanoate Openeye Name: [(1S)-2-[4-(isopropylsulfamoyl)anilino]-1-methyl-2-oxo-ethyl] 3-methylsulfanylpropanoate CAS Name: 3-(methylthio)propanoic acid [(2S)-1-oxo-1-[4-(propan-2-ylsulfamoyl)anilino]propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-[4-(propan-2-ylsulfamoyl)anilino]propan-2-yl] 3-methylsulfanylpropanoate Traditional Name: 3-(methylthio)propionic acid [(1S)-2-[4-(isopropylsulfamoyl)anilino]-2-keto-1-methyl-ethyl] ester Formula: C16H24N2O5S2 MolecularWeight: 388.50216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C(C)OC(=O)CCSC

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(C)C)OC(=O)CCSC

InChI

InChI=1S/C16H24N2O5S2/c1-11(2)18-25(21,22)14-7-5-13(6-8-14)17-16(20)12(3)23-15(19)9-10-24-4/h5-8,11-12,18H,9-10H2,1-4H3,(H,17,20)/t12-/m0/s1