N-[2-(cyanomethylsulfanyl)phenyl]-2-[4-(dimethylsulfamoyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[4-(dimethylsulfamoyl)piperazin-1-yl]ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-[4-(dimethylsulfamoyl)-1-piperazinyl]acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-[4-(dimethylsulfamoyl)piperazino]acetamide Formula: C16H23N5O3S2 MolecularWeight: 397.51552

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)CC(=O)NC2=CC=CC=C2SCC#N

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)CC(=O)NC2=CC=CC=C2SCC#N

InChI

InChI=1S/C16H23N5O3S2/c1-19(2)26(23,24)21-10-8-20(9-11-21)13-16(22)18-14-5-3-4-6-15(14)25-12-7-17/h3-6H,8-13H2,1-2H3,(H,18,22)