cyanomethyl (3S)-1-[4-(diethylsulfamoyl)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: cyanomethyl (3S)-1-[4-(diethylsulfamoyl)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: cyanomethyl (3S)-1-[4-(diethylsulfamoyl)phenyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[4-(diethylsulfamoyl)phenyl]-5-oxo-3-pyrrolidinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl (3S)-1-[4-(diethylsulfamoyl)phenyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-[4-(diethylsulfamoyl)phenyl]-5-keto-pyrrolidine-3-carboxylic acid cyanomethyl ester Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)OCC#N

InChI

InChI=1S/C17H21N3O5S/c1-3-19(4-2)26(23,24)15-7-5-14(6-8-15)20-12-13(11-16(20)21)17(22)25-10-9-18/h5-8,13H,3-4,10-12H2,1-2H3/t13-/m0/s1