N-[3-(diethylsulfamoyl)phenyl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[3-(diethylsulfamoyl)phenyl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[3-(diethylsulfamoyl)phenyl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[3-(diethylsulfamoyl)phenyl]-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[3-(diethylsulfamoyl)phenyl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[3-(diethylsulfamoyl)phenyl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C22H31N4O3S+ MolecularWeight: 431.57154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H30N4O3S/c1-3-26(4-2)30(28,29)21-12-8-9-19(17-21)23-22(27)18-24-13-15-25(16-14-24)20-10-6-5-7-11-20/h5-12,17H,3-4,13-16,18H2,1-2H3,(H,23,27)/p+1