2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide

Systemtic Name: 2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide Openeye Name: 2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: 2-[4-(diethylsulfamoyl)-1-piperazin-1-iumyl]-N-(5-methyl-2-phenyl-3-pyrazolyl)acetamide IUPAC Name: 2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C20H31N6O3S+ MolecularWeight: 435.56354

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=CC(=NN2C3=CC=CC=C3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=CC(=NN2C3=CC=CC=C3)C

InChI

InChI=1S/C20H30N6O3S/c1-4-24(5-2)30(28,29)25-13-11-23(12-14-25)16-20(27)21-19-15-17(3)22-26(19)18-9-7-6-8-10-18/h6-10,15H,4-5,11-14,16H2,1-3H3,(H,21,27)/p+1