[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl] 3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl] 3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl] 3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoate CAS Name: 3-[5-(dimethylsulfamoyl)-1-methyl-2-benzimidazolyl]propanoic acid [(2S)-1-oxo-1-(1-piperidinyl)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl] 3-[5-(dimethylsulfamoyl)-1-methylbenzimidazol-2-yl]propanoate Traditional Name: 3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propionic acid [(1S)-2-keto-1-methyl-2-piperidino-ethyl] ester Formula: C21H30N4O5S MolecularWeight: 450.5517

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)OC(=O)CCC2=NC3=C(N2C)C=CC(=C3)S(=O)(=O)N(C)C

Isomeric SMILES

C[C@@H](C(=O)N1CCCCC1)OC(=O)CCC2=NC3=C(N2C)C=CC(=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H30N4O5S/c1-15(21(27)25-12-6-5-7-13-25)30-20(26)11-10-19-22-17-14-16(31(28,29)23(2)3)8-9-18(17)24(19)4/h8-9,14-15H,5-7,10-13H2,1-4H3/t15-/m0/s1