2-chloranyl-N-[1-[4-(dimethylsulfamoyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[1-[4-(dimethylsulfamoyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[1-[4-(dimethylsulfamoyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-chloro-N-[1-[4-(dimethylsulfamoyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[1-[4-(dimethylsulfamoyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[1-[4-(dimethylsulfamoyl)piperazine-1-carbonyl]-3-(methylthio)propyl]benzamide Formula: C18H27ClN4O4S2 MolecularWeight: 463.01438

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C18H27ClN4O4S2/c1-21(2)29(26,27)23-11-9-22(10-12-23)18(25)16(8-13-28-3)20-17(24)14-6-4-5-7-15(14)19/h4-7,16H,8-13H2,1-3H3,(H,20,24)