4-[4-(2-cyanoethylsulfamoyl)phenyl]carbonyl-N,N-dimethyl-piperazine-1-sulfonamide

Systemtic Name: 4-[4-(2-cyanoethylsulfamoyl)phenyl]carbonyl-N,N-dimethyl-piperazine-1-sulfonamide Openeye Name: 4-[4-(2-cyanoethylsulfamoyl)benzoyl]-N,N-dimethyl-piperazine-1-sulfonamide CAS Name: 4-[[4-(2-cyanoethylsulfamoyl)phenyl]-oxomethyl]-N,N-dimethyl-1-piperazinesulfonamide IUPAC Name: 4-[4-(2-cyanoethylsulfamoyl)benzoyl]-N,N-dimethylpiperazine-1-sulfonamide Traditional Name: 4-[4-(2-cyanoethylsulfamoyl)benzoyl]-N,N-dimethyl-piperazine-1-sulfonamide Formula: C16H23N5O5S2 MolecularWeight: 429.51432

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N

InChI

InChI=1S/C16H23N5O5S2/c1-19(2)28(25,26)21-12-10-20(11-13-21)16(22)14-4-6-15(7-5-14)27(23,24)18-9-3-8-17/h4-7,18H,3,9-13H2,1-2H3